# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2017

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_shelx
_database_code_depnum_ccdc_archive 'CCDC 1509608'
_audit_update_record             
;
2017-03-17 deposited with the CCDC.
2017-03-21 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C29 H26 N P Pt'
_chemical_formula_sum            'C29 H26 N P Pt'
_chemical_formula_weight         614.56

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   9.1117(18)
_cell_length_b                   11.229(2)
_cell_length_c                   12.539(3)
_cell_angle_alpha                95.86(3)
_cell_angle_beta                 103.50(3)
_cell_angle_gamma                102.41(3)
_cell_volume                     1202.6(5)
_cell_formula_units_Z            2
_cell_measurement_temperature    298(2)
_cell_measurement_reflns_used    4210
_cell_measurement_theta_min      2.32
_cell_measurement_theta_max      25.00

_exptl_crystal_description       plate
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.697
_exptl_crystal_F_000             600
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.450
_exptl_crystal_size_mid          0.400
_exptl_crystal_size_min          0.300
_exptl_absorpt_coefficient_mu    5.917
_shelx_estimated_absorpt_T_min   0.176
_shelx_estimated_absorpt_T_max   0.270
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.1760
_exptl_absorpt_correction_T_max  0.2698
_exptl_absorpt_process_details   'shape of crystal determined optically'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      298(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'fine-focus sealed tube'
_diffrn_measurement_device_type  'STOE IPDS 2T'
_diffrn_measurement_method       'rotation method'
_diffrn_detector_area_resol_mean '0.15 mm'
_diffrn_reflns_number            8788
_diffrn_reflns_av_unetI/netI     0.0796
_diffrn_reflns_av_R_equivalents  0.0944
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_theta_min         2.320
_diffrn_reflns_theta_max         25.000
_diffrn_reflns_theta_full        25.000
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 0.994
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 0.994
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_point_group_measured_fraction_full 0.994
_reflns_number_total             4210
_reflns_number_gt                3432
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'X-Area (Stoe & Cie GmbH, 2005)'
_computing_cell_refinement       'X-Area (Stoe & Cie GmbH, 2005)'
_computing_data_reduction        'X-Area (Stoe & Cie GmbH, 2005)'
_computing_structure_solution    'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'ORTEP-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX (Farrugia, 1999)'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0516P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         4210
_refine_ls_number_parameters     290
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0546
_refine_ls_R_factor_gt           0.0424
_refine_ls_wR_factor_ref         0.0982
_refine_ls_wR_factor_gt          0.0952
_refine_ls_goodness_of_fit_ref   0.952
_refine_ls_restrained_S_all      0.952
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.30408(4) 0.29375(3) 0.56349(2) 0.04519(12) Uani 1 1 d . . . . .
P1 P 0.2616(2) 0.28155(17) 0.37395(15) 0.0442(5) Uani 1 1 d . . . . .
N1 N 0.5154(8) 0.2329(6) 0.6096(5) 0.0559(18) Uani 1 1 d . . . . .
C1 C 0.3363(12) 0.3220(7) 0.7329(6) 0.060(2) Uani 1 1 d . . . . .
C2 C 0.2553(14) 0.3575(8) 0.7988(7) 0.072(3) Uani 1 1 d . . . . .
H2 H 0.162561 0.377271 0.766636 0.087 Uiso 1 1 calc R U . . .
C3 C 0.3016(15) 0.3674(9) 0.9165(7) 0.081(3) Uani 1 1 d . . . . .
H3 H 0.239089 0.392467 0.958826 0.098 Uiso 1 1 calc R U . . .
C4 C 0.4360(17) 0.3406(9) 0.9670(8) 0.089(4) Uani 1 1 d . . . . .
H4 H 0.466144 0.348910 1.044045 0.107 Uiso 1 1 calc R U . . .
C5 C 0.5295(14) 0.3009(9) 0.9052(7) 0.075(3) Uani 1 1 d . . . . .
C6 C 0.4816(11) 0.2889(7) 0.7886(6) 0.059(2) Uani 1 1 d . . . . .
C7 C 0.6731(16) 0.2699(12) 0.9517(9) 0.098(4) Uani 1 1 d . . . . .
H7 H 0.707349 0.277140 1.028487 0.118 Uiso 1 1 calc R U . . .
C8 C 0.7595(15) 0.2315(12) 0.8902(10) 0.093(4) Uani 1 1 d . . . . .
H8 H 0.854601 0.216406 0.923995 0.111 Uiso 1 1 calc R U . . .
C9 C 0.7058(11) 0.2135(9) 0.7729(8) 0.070(3) Uani 1 1 d . . . . .
C10 C 0.5713(11) 0.2447(7) 0.7229(6) 0.055(2) Uani 1 1 d . . . . .
C11 C 0.5926(13) 0.1855(10) 0.5480(9) 0.078(3) Uani 1 1 d . . . . .
H11 H 0.555527 0.176338 0.471245 0.093 Uiso 1 1 calc R U . . .
C12 C 0.7245(13) 0.1488(11) 0.5902(10) 0.085(3) Uani 1 1 d . . . . .
H12 H 0.772482 0.111394 0.543107 0.101 Uiso 1 1 calc R U . . .
C13 C 0.7863(12) 0.1682(11) 0.7050(10) 0.082(3) Uani 1 1 d . . . . .
H13 H 0.881127 0.150639 0.735339 0.099 Uiso 1 1 calc R U . . .
C14 C 0.1007(11) 0.3471(9) 0.5461(7) 0.061(2) Uani 1 1 d . . . . .
H14A H 0.054173 0.322859 0.604307 0.091 Uiso 1 1 calc R U . . .
H14B H 0.030662 0.308423 0.475330 0.091 Uiso 1 1 calc R U . . .
H14C H 0.121453 0.435266 0.550537 0.091 Uiso 1 1 calc R U . . .
C15 C 0.2319(12) 0.4300(7) 0.3338(6) 0.060(2) Uani 1 1 d . . . . .
H15A H 0.145943 0.447531 0.360614 0.072 Uiso 1 1 calc R U . . .
H15B H 0.324185 0.493984 0.373098 0.072 Uiso 1 1 calc R U . . .
C16 C 0.1996(13) 0.4421(8) 0.2144(7) 0.068(3) Uani 1 1 d . . . . .
H16 H 0.279594 0.440922 0.180124 0.082 Uiso 1 1 calc R U . . .
C17 C 0.0682(15) 0.4541(11) 0.1536(9) 0.094(4) Uani 1 1 d . . . . .
H17A H -0.014611 0.455630 0.184776 0.113 Uiso 1 1 calc R U . . .
H17B H 0.057301 0.461120 0.079072 0.113 Uiso 1 1 calc R U . . .
C18 C 0.0902(9) 0.1612(7) 0.2926(6) 0.0464(18) Uani 1 1 d . . . . .
C19 C 0.0411(10) 0.1357(8) 0.1811(6) 0.056(2) Uani 1 1 d . . . . .
H19 H 0.093186 0.186125 0.140321 0.068 Uiso 1 1 calc R U . . .
C20 C -0.0813(11) 0.0396(9) 0.1245(7) 0.063(2) Uani 1 1 d . . . . .
H20 H -0.110733 0.024966 0.047199 0.075 Uiso 1 1 calc R U . . .
C21 C -0.1609(10) -0.0357(8) 0.1845(8) 0.062(2) Uani 1 1 d . . . . .
H21 H -0.245077 -0.101047 0.147579 0.074 Uiso 1 1 calc R U . . .
C22 C -0.1148(11) -0.0133(8) 0.2986(7) 0.062(2) Uani 1 1 d . . . . .
H22 H -0.168556 -0.063342 0.338824 0.075 Uiso 1 1 calc R U . . .
C23 C 0.0110(10) 0.0833(7) 0.3541(6) 0.054(2) Uani 1 1 d . . . . .
H23 H 0.043420 0.097020 0.431350 0.064 Uiso 1 1 calc R U . . .
C24 C 0.4146(9) 0.2572(7) 0.3096(5) 0.0459(18) Uani 1 1 d . . . . .
C25 C 0.5479(9) 0.3513(8) 0.3265(7) 0.055(2) Uani 1 1 d . . . . .
H25 H 0.551348 0.429699 0.360681 0.066 Uiso 1 1 calc R U . . .
C26 C 0.6759(10) 0.3304(9) 0.2935(8) 0.065(2) Uani 1 1 d . . . . .
H26 H 0.765182 0.394068 0.306196 0.078 Uiso 1 1 calc R U . . .
C27 C 0.6704(11) 0.2164(10) 0.2423(7) 0.066(2) Uani 1 1 d . . . . .
H27 H 0.756675 0.202500 0.220275 0.079 Uiso 1 1 calc R U . . .
C28 C 0.5387(12) 0.1208(9) 0.2225(8) 0.072(3) Uani 1 1 d . . . . .
H28 H 0.535784 0.043001 0.187300 0.087 Uiso 1 1 calc R U . . .
C29 C 0.4113(10) 0.1425(8) 0.2558(7) 0.059(2) Uani 1 1 d . . . . .
H29 H 0.321739 0.078815 0.241871 0.071 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 C14 2.039(9) . ?
Pt1 C1 2.057(8) . ?
Pt1 N1 2.153(7) . ?
Pt1 P1 2.3019(19) . ?
P1 C24 1.819(9) . ?
P1 C18 1.837(8) . ?
P1 C15 1.846(7) . ?
N1 C11 1.305(13) . ?
N1 C10 1.375(10) . ?
C1 C2 1.315(14) . ?
C1 C6 1.488(13) . ?
C2 C3 1.422(12) . ?
C2 H2 0.9300 . ?
C3 C4 1.352(16) . ?
C3 H3 0.9300 . ?
C4 C5 1.388(17) . ?
C4 H4 0.9300 . ?
C5 C6 1.408(11) . ?
C5 C7 1.432(17) . ?
C6 C10 1.414(14) . ?
C7 C8 1.33(2) . ?
C7 H7 0.9300 . ?
C8 C9 1.416(14) . ?
C8 H8 0.9300 . ?
C9 C13 1.372(16) . ?
C9 C10 1.375(13) . ?
C11 C12 1.362(14) . ?
C11 H11 0.9300 . ?
C12 C13 1.394(15) . ?
C12 H12 0.9300 . ?
C13 H13 0.9300 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C15 C16 1.483(11) . ?
C15 H15A 0.9700 . ?
C15 H15B 0.9700 . ?
C16 C17 1.302(13) . ?
C16 H16 0.9300 . ?
C17 H17A 0.9300 . ?
C17 H17B 0.9300 . ?
C18 C19 1.344(10) . ?
C18 C23 1.417(11) . ?
C19 C20 1.367(12) . ?
C19 H19 0.9300 . ?
C20 C21 1.388(13) . ?
C20 H20 0.9300 . ?
C21 C22 1.374(12) . ?
C21 H21 0.9300 . ?
C22 C23 1.383(12) . ?
C22 H22 0.9300 . ?
C23 H23 0.9300 . ?
C24 C29 1.383(12) . ?
C24 C25 1.385(11) . ?
C25 C26 1.382(13) . ?
C25 H25 0.9300 . ?
C26 C27 1.357(13) . ?
C26 H26 0.9300 . ?
C27 C28 1.381(14) . ?
C27 H27 0.9300 . ?
C28 C29 1.381(13) . ?
C28 H28 0.9300 . ?
C29 H29 0.9300 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C14 Pt1 C1 88.9(4) . . ?
C14 Pt1 N1 170.3(3) . . ?
C1 Pt1 N1 81.9(3) . . ?
C14 Pt1 P1 87.0(2) . . ?
C1 Pt1 P1 174.1(2) . . ?
N1 Pt1 P1 102.4(2) . . ?
C24 P1 C18 103.4(4) . . ?
C24 P1 C15 102.1(4) . . ?
C18 P1 C15 106.8(4) . . ?
C24 P1 Pt1 119.4(2) . . ?
C18 P1 Pt1 114.5(3) . . ?
C15 P1 Pt1 109.3(3) . . ?
C11 N1 C10 117.3(8) . . ?
C11 N1 Pt1 130.5(6) . . ?
C10 N1 Pt1 112.1(6) . . ?
C2 C1 C6 115.9(8) . . ?
C2 C1 Pt1 134.2(8) . . ?
C6 C1 Pt1 109.9(7) . . ?
C1 C2 C3 123.6(11) . . ?
C1 C2 H2 118.2 . . ?
C3 C2 H2 118.2 . . ?
C4 C3 C2 120.3(11) . . ?
C4 C3 H3 119.9 . . ?
C2 C3 H3 119.9 . . ?
C3 C4 C5 120.8(9) . . ?
C3 C4 H4 119.6 . . ?
C5 C4 H4 119.6 . . ?
C4 C5 C6 118.7(10) . . ?
C4 C5 C7 124.6(10) . . ?
C6 C5 C7 116.8(12) . . ?
C5 C6 C10 120.2(9) . . ?
C5 C6 C1 120.7(10) . . ?
C10 C6 C1 119.1(7) . . ?
C8 C7 C5 123.1(10) . . ?
C8 C7 H7 118.4 . . ?
C5 C7 H7 118.4 . . ?
C7 C8 C9 119.5(11) . . ?
C7 C8 H8 120.2 . . ?
C9 C8 H8 120.2 . . ?
C13 C9 C10 117.5(9) . . ?
C13 C9 C8 122.2(11) . . ?
C10 C9 C8 120.3(12) . . ?
C9 C10 N1 123.2(9) . . ?
C9 C10 C6 119.9(8) . . ?
N1 C10 C6 116.9(8) . . ?
N1 C11 C12 123.6(10) . . ?
N1 C11 H11 118.2 . . ?
C12 C11 H11 118.2 . . ?
C11 C12 C13 118.9(11) . . ?
C11 C12 H12 120.6 . . ?
C13 C12 H12 120.6 . . ?
C9 C13 C12 119.3(9) . . ?
C9 C13 H13 120.3 . . ?
C12 C13 H13 120.3 . . ?
Pt1 C14 H14A 109.5 . . ?
Pt1 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
Pt1 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C16 C15 P1 118.5(6) . . ?
C16 C15 H15A 107.7 . . ?
P1 C15 H15A 107.7 . . ?
C16 C15 H15B 107.7 . . ?
P1 C15 H15B 107.7 . . ?
H15A C15 H15B 107.1 . . ?
C17 C16 C15 125.3(11) . . ?
C17 C16 H16 117.4 . . ?
C15 C16 H16 117.4 . . ?
C16 C17 H17A 120.0 . . ?
C16 C17 H17B 120.0 . . ?
H17A C17 H17B 120.0 . . ?
C19 C18 C23 117.9(7) . . ?
C19 C18 P1 125.9(6) . . ?
C23 C18 P1 116.0(6) . . ?
C18 C19 C20 123.6(8) . . ?
C18 C19 H19 118.2 . . ?
C20 C19 H19 118.2 . . ?
C19 C20 C21 118.7(8) . . ?
C19 C20 H20 120.6 . . ?
C21 C20 H20 120.6 . . ?
C22 C21 C20 119.8(8) . . ?
C22 C21 H21 120.1 . . ?
C20 C21 H21 120.1 . . ?
C21 C22 C23 120.4(8) . . ?
C21 C22 H22 119.8 . . ?
C23 C22 H22 119.8 . . ?
C22 C23 C18 119.6(7) . . ?
C22 C23 H23 120.2 . . ?
C18 C23 H23 120.2 . . ?
C29 C24 C25 118.1(8) . . ?
C29 C24 P1 121.8(6) . . ?
C25 C24 P1 119.5(6) . . ?
C26 C25 C24 121.1(9) . . ?
C26 C25 H25 119.5 . . ?
C24 C25 H25 119.5 . . ?
C27 C26 C25 119.6(9) . . ?
C27 C26 H26 120.2 . . ?
C25 C26 H26 120.2 . . ?
C26 C27 C28 121.1(9) . . ?
C26 C27 H27 119.5 . . ?
C28 C27 H27 119.5 . . ?
C27 C28 C29 119.0(9) . . ?
C27 C28 H28 120.5 . . ?
C29 C28 H28 120.5 . . ?
C28 C29 C24 121.2(9) . . ?
C28 C29 H29 119.4 . . ?
C24 C29 H29 119.4 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C6 C1 C2 C3 1.3(13) . . . . ?
Pt1 C1 C2 C3 178.4(7) . . . . ?
C1 C2 C3 C4 0.5(15) . . . . ?
C2 C3 C4 C5 -1.2(16) . . . . ?
C3 C4 C5 C6 -0.1(15) . . . . ?
C3 C4 C5 C7 -179.7(10) . . . . ?
C4 C5 C6 C10 -177.9(9) . . . . ?
C7 C5 C6 C10 1.8(12) . . . . ?
C4 C5 C6 C1 2.0(12) . . . . ?
C7 C5 C6 C1 -178.4(8) . . . . ?
C2 C1 C6 C5 -2.6(11) . . . . ?
Pt1 C1 C6 C5 179.7(6) . . . . ?
C2 C1 C6 C10 177.3(8) . . . . ?
Pt1 C1 C6 C10 -0.5(9) . . . . ?
C4 C5 C7 C8 179.6(12) . . . . ?
C6 C5 C7 C8 0.0(16) . . . . ?
C5 C7 C8 C9 -3.3(19) . . . . ?
C7 C8 C9 C13 -176.8(11) . . . . ?
C7 C8 C9 C10 5.0(16) . . . . ?
C13 C9 C10 N1 -0.2(13) . . . . ?
C8 C9 C10 N1 178.1(8) . . . . ?
C13 C9 C10 C6 178.4(9) . . . . ?
C8 C9 C10 C6 -3.3(13) . . . . ?
C11 N1 C10 C9 2.5(12) . . . . ?
Pt1 N1 C10 C9 -179.1(6) . . . . ?
C11 N1 C10 C6 -176.2(8) . . . . ?
Pt1 N1 C10 C6 2.2(8) . . . . ?
C5 C6 C10 C9 -0.1(12) . . . . ?
C1 C6 C10 C9 -179.9(7) . . . . ?
C5 C6 C10 N1 178.6(7) . . . . ?
C1 C6 C10 N1 -1.2(11) . . . . ?
C10 N1 C11 C12 -0.6(15) . . . . ?
Pt1 N1 C11 C12 -178.6(8) . . . . ?
N1 C11 C12 C13 -3.5(17) . . . . ?
C10 C9 C13 C12 -3.9(14) . . . . ?
C8 C9 C13 C12 177.9(10) . . . . ?
C11 C12 C13 C9 5.7(16) . . . . ?
C24 P1 C15 C16 53.6(8) . . . . ?
C18 P1 C15 C16 -54.5(9) . . . . ?
Pt1 P1 C15 C16 -178.9(7) . . . . ?
P1 C15 C16 C17 112.3(11) . . . . ?
C24 P1 C18 C19 -48.4(8) . . . . ?
C15 P1 C18 C19 58.9(8) . . . . ?
Pt1 P1 C18 C19 -179.9(6) . . . . ?
C24 P1 C18 C23 126.7(6) . . . . ?
C15 P1 C18 C23 -126.1(7) . . . . ?
Pt1 P1 C18 C23 -4.9(7) . . . . ?
C23 C18 C19 C20 0.5(13) . . . . ?
P1 C18 C19 C20 175.4(7) . . . . ?
C18 C19 C20 C21 0.6(14) . . . . ?
C19 C20 C21 C22 -0.6(14) . . . . ?
C20 C21 C22 C23 -0.4(14) . . . . ?
C21 C22 C23 C18 1.5(14) . . . . ?
C19 C18 C23 C22 -1.5(13) . . . . ?
P1 C18 C23 C22 -177.0(7) . . . . ?
C18 P1 C24 C29 -27.4(7) . . . . ?
C15 P1 C24 C29 -138.1(6) . . . . ?
Pt1 P1 C24 C29 101.2(6) . . . . ?
C18 P1 C24 C25 161.1(6) . . . . ?
C15 P1 C24 C25 50.3(6) . . . . ?
Pt1 P1 C24 C25 -70.3(6) . . . . ?
C29 C24 C25 C26 -1.8(11) . . . . ?
P1 C24 C25 C26 170.1(6) . . . . ?
C24 C25 C26 C27 0.8(12) . . . . ?
C25 C26 C27 C28 0.1(13) . . . . ?
C26 C27 C28 C29 -0.1(14) . . . . ?
C27 C28 C29 C24 -0.9(13) . . . . ?
C25 C24 C29 C28 1.8(12) . . . . ?
P1 C24 C29 C28 -169.9(7) . . . . ?

_refine_diff_density_max         1.739
_refine_diff_density_min         -2.426
_refine_diff_density_rms         0.159

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_shelx
_database_code_depnum_ccdc_archive 'CCDC 1509609'
_audit_update_record             
;
2017-03-17 deposited with the CCDC.
2017-03-21 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C27 H26 N P Pt'
_chemical_formula_sum            'C27 H26 N P Pt'
_chemical_formula_weight         590.54

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   9.759(2)
_cell_length_b                   10.351(2)
_cell_length_c                   23.222(5)
_cell_angle_alpha                90
_cell_angle_beta                 100.86(3)
_cell_angle_gamma                90
_cell_volume                     2303.9(8)
_cell_formula_units_Z            4
_cell_measurement_temperature    298(2)
_cell_measurement_reflns_used    4041
_cell_measurement_theta_min      2.14
_cell_measurement_theta_max      25.00

_exptl_crystal_description       needle
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.703
_exptl_crystal_F_000             1152
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.450
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.150
_exptl_absorpt_coefficient_mu    6.174
_shelx_estimated_absorpt_T_min   0.168
_shelx_estimated_absorpt_T_max   0.458
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.1677
_exptl_absorpt_correction_T_max  0.4578
_exptl_absorpt_process_details   'shape of crystal determined optically'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      298(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'fine-focus sealed tube'
_diffrn_measurement_device_type  'STOE IPDS 2T'
_diffrn_measurement_method       'rotation method'
_diffrn_detector_area_resol_mean '0.15 mm'
_diffrn_reflns_number            10787
_diffrn_reflns_av_unetI/netI     0.0806
_diffrn_reflns_av_R_equivalents  0.0677
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_k_min       -11
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_theta_min         2.144
_diffrn_reflns_theta_max         24.997
_diffrn_reflns_theta_full        24.997
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measured_fraction_theta_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.995
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.995
_diffrn_reflns_point_group_measured_fraction_full 0.995
_reflns_number_total             4041
_reflns_number_gt                2782
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'X-Area (Stoe & Cie GmbH, 2005)'
_computing_cell_refinement       'X-Area (Stoe & Cie GmbH, 2005)'
_computing_data_reduction        'X-Area (Stoe & Cie GmbH, 2005)'
_computing_structure_solution    'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'ORTEP-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX (Farrugia, 1999)'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0667P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         4041
_refine_ls_number_parameters     230
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0777
_refine_ls_R_factor_gt           0.0458
_refine_ls_wR_factor_ref         0.1159
_refine_ls_wR_factor_gt          0.0987
_refine_ls_goodness_of_fit_ref   0.926
_refine_ls_restrained_S_all      0.926
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.34482(4) 0.35049(4) 0.13515(2) 0.03983(15) Uani 1 1 d . . . . .
P1 P 0.2331(3) 0.2235(3) 0.05933(10) 0.0440(6) Uani 1 1 d . . . . .
N1 N 0.1853(9) 0.4699(8) 0.1585(3) 0.041(2) Uani 1 1 d . . . . .
C1 C 0.4576(11) 0.4627(11) 0.1991(3) 0.043(2) Uani 1 1 d . . . . .
C2 C 0.6033(11) 0.4585(13) 0.2217(4) 0.055(3) Uani 1 1 d . . . . .
H2 H 0.656413 0.392878 0.209571 0.066 Uiso 1 1 calc R U . . .
C3 C 0.6686(14) 0.5501(15) 0.2614(4) 0.069(4) Uani 1 1 d . . . . .
H3 H 0.764394 0.546035 0.275037 0.083 Uiso 1 1 calc R U . . .
C4 C 0.5927(18) 0.6451(17) 0.2802(5) 0.084(5) Uani 1 1 d . . . . .
H4 H 0.637377 0.705144 0.307191 0.101 Uiso 1 1 calc R U . . .
C5 C 0.4539(14) 0.6550(13) 0.2609(5) 0.063(3) Uani 1 1 d . . . . .
H5 H 0.403073 0.722345 0.273053 0.076 Uiso 1 1 calc R U . . .
C6 C 0.3871(11) 0.5588(11) 0.2210(4) 0.048(3) Uani 1 1 d . . . . .
C7 C 0.2353(12) 0.5594(10) 0.1998(4) 0.047(3) Uani 1 1 d . . . . .
C8 C 0.1347(13) 0.6417(12) 0.2197(4) 0.055(3) Uani 1 1 d . . . . .
H8 H 0.166191 0.703308 0.248278 0.066 Uiso 1 1 calc R U . . .
C9 C -0.0036(16) 0.6328(13) 0.1985(5) 0.068(4) Uani 1 1 d . . . . .
H9 H -0.066683 0.687383 0.211794 0.082 Uiso 1 1 calc R U . . .
C10 C -0.0471(13) 0.5422(13) 0.1575(5) 0.060(3) Uani 1 1 d . . . . .
H10 H -0.141370 0.534519 0.141235 0.073 Uiso 1 1 calc R U . . .
C11 C 0.0502(12) 0.4599(11) 0.1397(4) 0.049(3) Uani 1 1 d . . . . .
H11 H 0.017691 0.394615 0.113083 0.059 Uiso 1 1 calc R U . . .
C12 C 0.5177(13) 0.2504(14) 0.1236(5) 0.066(3) Uani 1 1 d . . . . .
H12A H 0.596883 0.307281 0.129506 0.100 Uiso 1 1 calc R U . . .
H12B H 0.503198 0.216079 0.084545 0.100 Uiso 1 1 calc R U . . .
H12C H 0.534526 0.180869 0.151399 0.100 Uiso 1 1 calc R U . . .
C13 C 0.2605(18) 0.0481(13) 0.0714(5) 0.082(3) Uani 1 1 d . . . . .
H13A H 0.186686 0.002110 0.045675 0.099 Uiso 1 1 calc R U . . .
H13B H 0.348158 0.024277 0.060405 0.099 Uiso 1 1 calc R U . . .
C14 C 0.2631(18) 0.0055(14) 0.1319(6) 0.082(3) Uani 1 1 d . . . . .
H14 H 0.325542 0.045734 0.161647 0.099 Uiso 1 1 calc R U . . .
C15 C 0.1831(17) -0.0856(14) 0.1467(6) 0.082(3) Uani 1 1 d . . . . .
H15A H 0.119497 -0.127782 0.117947 0.099 Uiso 1 1 calc R U . . .
H15B H 0.189985 -0.108050 0.185881 0.099 Uiso 1 1 calc R U . . .
C16 C 0.0454(13) 0.2336(10) 0.0356(4) 0.052(3) Uani 1 1 d . . . . .
C17 C -0.0495(13) 0.1705(11) 0.0660(4) 0.055(3) Uani 1 1 d . . . . .
H17 H -0.013331 0.113764 0.096119 0.066 Uiso 1 1 calc R U . . .
C18 C -0.1889(16) 0.1885(12) 0.0536(6) 0.070(4) Uani 1 1 d . . . . .
H18 H -0.245948 0.146170 0.075397 0.084 Uiso 1 1 calc R U . . .
C19 C -0.2461(13) 0.2689(14) 0.0090(5) 0.066(3) Uani 1 1 d . . . . .
H19 H -0.342138 0.281318 0.000428 0.079 Uiso 1 1 calc R U . . .
C20 C -0.1628(16) 0.3310(14) -0.0232(6) 0.079(4) Uani 1 1 d . . . . .
H20 H -0.201962 0.385958 -0.053559 0.095 Uiso 1 1 calc R U . . .
C21 C -0.0198(12) 0.3121(12) -0.0104(4) 0.055(3) Uani 1 1 d . . . . .
H21 H 0.035090 0.353369 -0.033486 0.066 Uiso 1 1 calc R U . . .
C22 C 0.2995(15) 0.2488(13) -0.0085(5) 0.0694(15) Uani 1 1 d . . . . .
C23 C 0.2690(15) 0.1572(13) -0.0537(5) 0.0694(15) Uani 1 1 d . . . . .
H23 H 0.214187 0.085437 -0.049672 0.083 Uiso 1 1 calc R U . . .
C24 C 0.3235(15) 0.1761(12) -0.1055(5) 0.0694(15) Uani 1 1 d . . . . .
H24 H 0.310553 0.113288 -0.134673 0.083 Uiso 1 1 calc R U . . .
C25 C 0.3940(15) 0.2850(13) -0.1125(5) 0.0694(15) Uani 1 1 d . . . . .
H25 H 0.434573 0.295141 -0.145439 0.083 Uiso 1 1 calc R U . . .
C26 C 0.4056(15) 0.3773(12) -0.0727(5) 0.0694(15) Uani 1 1 d . . . . .
H26 H 0.444528 0.456074 -0.080234 0.083 Uiso 1 1 calc R U . . .
C27 C 0.3613(15) 0.3602(13) -0.0197(5) 0.0694(15) Uani 1 1 d . . . . .
H27 H 0.374291 0.425843 0.008131 0.083 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 C1 2.037(10) . ?
Pt1 C12 2.040(12) . ?
Pt1 N1 2.136(8) . ?
Pt1 P1 2.301(3) . ?
P1 C16 1.814(13) . ?
P1 C22 1.831(11) . ?
P1 C13 1.849(14) . ?
N1 C11 1.313(13) . ?
N1 C7 1.357(12) . ?
C1 C6 1.361(15) . ?
C1 C2 1.420(14) . ?
C2 C3 1.391(17) . ?
C2 H2 0.9300 . ?
C3 C4 1.35(2) . ?
C3 H3 0.9300 . ?
C4 C5 1.35(2) . ?
C4 H4 0.9300 . ?
C5 C6 1.430(16) . ?
C5 H5 0.9300 . ?
C6 C7 1.471(15) . ?
C7 C8 1.440(15) . ?
C8 C9 1.349(18) . ?
C8 H8 0.9300 . ?
C9 C10 1.347(17) . ?
C9 H9 0.9300 . ?
C10 C11 1.396(15) . ?
C10 H10 0.9300 . ?
C11 H11 0.9300 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C13 C14 1.467(16) . ?
C13 H13A 0.9700 . ?
C13 H13B 0.9700 . ?
C14 C15 1.310(19) . ?
C14 H14 0.9300 . ?
C15 H15A 0.9300 . ?
C15 H15B 0.9300 . ?
C16 C21 1.396(15) . ?
C16 C17 1.425(15) . ?
C17 C18 1.350(18) . ?
C17 H17 0.9300 . ?
C18 C19 1.363(17) . ?
C18 H18 0.9300 . ?
C19 C20 1.364(17) . ?
C19 H19 0.9300 . ?
C20 C21 1.385(18) . ?
C20 H20 0.9300 . ?
C21 H21 0.9300 . ?
C22 C27 1.349(17) . ?
C22 C23 1.404(16) . ?
C23 C24 1.419(15) . ?
C23 H23 0.9300 . ?
C24 C25 1.346(17) . ?
C24 H24 0.9300 . ?
C25 C26 1.321(16) . ?
C25 H25 0.9300 . ?
C26 C27 1.389(15) . ?
C26 H26 0.9300 . ?
C27 H27 0.9300 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 Pt1 C12 92.2(5) . . ?
C1 Pt1 N1 78.7(4) . . ?
C12 Pt1 N1 170.9(4) . . ?
C1 Pt1 P1 175.4(3) . . ?
C12 Pt1 P1 83.9(4) . . ?
N1 Pt1 P1 105.2(2) . . ?
C16 P1 C22 103.3(5) . . ?
C16 P1 C13 102.2(6) . . ?
C22 P1 C13 101.9(6) . . ?
C16 P1 Pt1 120.4(3) . . ?
C22 P1 Pt1 112.5(4) . . ?
C13 P1 Pt1 114.3(5) . . ?
C11 N1 C7 119.6(9) . . ?
C11 N1 Pt1 127.1(7) . . ?
C7 N1 Pt1 113.2(7) . . ?
C6 C1 C2 115.2(10) . . ?
C6 C1 Pt1 116.6(7) . . ?
C2 C1 Pt1 128.1(8) . . ?
C3 C2 C1 121.7(12) . . ?
C3 C2 H2 119.1 . . ?
C1 C2 H2 119.1 . . ?
C4 C3 C2 120.0(13) . . ?
C4 C3 H3 120.0 . . ?
C2 C3 H3 120.0 . . ?
C5 C4 C3 121.6(13) . . ?
C5 C4 H4 119.2 . . ?
C3 C4 H4 119.2 . . ?
C4 C5 C6 118.0(13) . . ?
C4 C5 H5 121.0 . . ?
C6 C5 H5 121.0 . . ?
C1 C6 C5 123.4(11) . . ?
C1 C6 C7 115.2(9) . . ?
C5 C6 C7 121.4(11) . . ?
N1 C7 C8 117.1(10) . . ?
N1 C7 C6 116.0(9) . . ?
C8 C7 C6 126.9(10) . . ?
C9 C8 C7 122.6(11) . . ?
C9 C8 H8 118.7 . . ?
C7 C8 H8 118.7 . . ?
C10 C9 C8 117.7(12) . . ?
C10 C9 H9 121.1 . . ?
C8 C9 H9 121.1 . . ?
C9 C10 C11 119.6(12) . . ?
C9 C10 H10 120.2 . . ?
C11 C10 H10 120.2 . . ?
N1 C11 C10 123.3(10) . . ?
N1 C11 H11 118.3 . . ?
C10 C11 H11 118.3 . . ?
Pt1 C12 H12A 109.5 . . ?
Pt1 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
Pt1 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C14 C13 P1 114.6(10) . . ?
C14 C13 H13A 108.6 . . ?
P1 C13 H13A 108.6 . . ?
C14 C13 H13B 108.6 . . ?
P1 C13 H13B 108.6 . . ?
H13A C13 H13B 107.6 . . ?
C15 C14 C13 124.3(15) . . ?
C15 C14 H14 117.8 . . ?
C13 C14 H14 117.8 . . ?
C14 C15 H15A 120.0 . . ?
C14 C15 H15B 120.0 . . ?
H15A C15 H15B 120.0 . . ?
C21 C16 C17 113.7(11) . . ?
C21 C16 P1 123.7(8) . . ?
C17 C16 P1 122.4(9) . . ?
C18 C17 C16 123.6(12) . . ?
C18 C17 H17 118.2 . . ?
C16 C17 H17 118.2 . . ?
C17 C18 C19 119.9(12) . . ?
C17 C18 H18 120.0 . . ?
C19 C18 H18 120.0 . . ?
C18 C19 C20 120.2(12) . . ?
C18 C19 H19 119.9 . . ?
C20 C19 H19 119.9 . . ?
C19 C20 C21 119.7(12) . . ?
C19 C20 H20 120.1 . . ?
C21 C20 H20 120.1 . . ?
C20 C21 C16 122.8(11) . . ?
C20 C21 H21 118.6 . . ?
C16 C21 H21 118.6 . . ?
C27 C22 C23 118.2(10) . . ?
C27 C22 P1 122.1(9) . . ?
C23 C22 P1 119.1(9) . . ?
C22 C23 C24 118.7(12) . . ?
C22 C23 H23 120.6 . . ?
C24 C23 H23 120.6 . . ?
C25 C24 C23 120.0(12) . . ?
C25 C24 H24 120.0 . . ?
C23 C24 H24 120.0 . . ?
C26 C25 C24 119.9(11) . . ?
C26 C25 H25 120.0 . . ?
C24 C25 H25 120.0 . . ?
C25 C26 C27 121.9(12) . . ?
C25 C26 H26 119.1 . . ?
C27 C26 H26 119.1 . . ?
C22 C27 C26 120.3(12) . . ?
C22 C27 H27 119.8 . . ?
C26 C27 H27 119.8 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C6 C1 C2 C3 -2.6(14) . . . . ?
Pt1 C1 C2 C3 173.3(8) . . . . ?
C1 C2 C3 C4 1.0(16) . . . . ?
C2 C3 C4 C5 -0.8(19) . . . . ?
C3 C4 C5 C6 2.2(19) . . . . ?
C2 C1 C6 C5 4.0(14) . . . . ?
Pt1 C1 C6 C5 -172.4(8) . . . . ?
C2 C1 C6 C7 -177.2(8) . . . . ?
Pt1 C1 C6 C7 6.4(11) . . . . ?
C4 C5 C6 C1 -4.0(17) . . . . ?
C4 C5 C6 C7 177.3(10) . . . . ?
C11 N1 C7 C8 -1.5(13) . . . . ?
Pt1 N1 C7 C8 -178.1(7) . . . . ?
C11 N1 C7 C6 176.4(9) . . . . ?
Pt1 N1 C7 C6 -0.1(10) . . . . ?
C1 C6 C7 N1 -4.0(12) . . . . ?
C5 C6 C7 N1 174.8(9) . . . . ?
C1 C6 C7 C8 173.7(9) . . . . ?
C5 C6 C7 C8 -7.5(16) . . . . ?
N1 C7 C8 C9 -0.6(15) . . . . ?
C6 C7 C8 C9 -178.3(11) . . . . ?
C7 C8 C9 C10 0.5(18) . . . . ?
C8 C9 C10 C11 1.5(18) . . . . ?
C7 N1 C11 C10 3.7(15) . . . . ?
Pt1 N1 C11 C10 179.7(8) . . . . ?
C9 C10 C11 N1 -3.8(17) . . . . ?
C16 P1 C13 C14 -93.5(12) . . . . ?
C22 P1 C13 C14 159.8(12) . . . . ?
Pt1 P1 C13 C14 38.2(14) . . . . ?
P1 C13 C14 C15 125.4(15) . . . . ?
C22 P1 C16 C21 -32.2(10) . . . . ?
C13 P1 C16 C21 -137.8(9) . . . . ?
Pt1 P1 C16 C21 94.3(9) . . . . ?
C22 P1 C16 C17 153.8(9) . . . . ?
C13 P1 C16 C17 48.2(9) . . . . ?
Pt1 P1 C16 C17 -79.7(9) . . . . ?
C21 C16 C17 C18 -2.7(16) . . . . ?
P1 C16 C17 C18 171.9(9) . . . . ?
C16 C17 C18 C19 1.3(18) . . . . ?
C17 C18 C19 C20 0.1(19) . . . . ?
C18 C19 C20 C21 0(2) . . . . ?
C19 C20 C21 C16 -2(2) . . . . ?
C17 C16 C21 C20 2.9(16) . . . . ?
P1 C16 C21 C20 -171.6(10) . . . . ?
C16 P1 C22 C27 106.3(13) . . . . ?
C13 P1 C22 C27 -147.9(13) . . . . ?
Pt1 P1 C22 C27 -25.1(14) . . . . ?
C16 P1 C22 C23 -64.9(12) . . . . ?
C13 P1 C22 C23 40.9(13) . . . . ?
Pt1 P1 C22 C23 163.7(10) . . . . ?
C27 C22 C23 C24 10(2) . . . . ?
P1 C22 C23 C24 -178.6(11) . . . . ?
C22 C23 C24 C25 -5(2) . . . . ?
C23 C24 C25 C26 -4(2) . . . . ?
C24 C25 C26 C27 8(2) . . . . ?
C23 C22 C27 C26 -6(2) . . . . ?
P1 C22 C27 C26 -177.6(11) . . . . ?
C25 C26 C27 C22 -3(2) . . . . ?

_refine_diff_density_max         1.442
_refine_diff_density_min         -2.150
_refine_diff_density_rms         0.191

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_shelx
_database_code_depnum_ccdc_archive 'CCDC 1538745'
_audit_update_record             
;
2017-03-17 deposited with the CCDC.
2017-03-21 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C30 H26 N P Pt'
_chemical_formula_sum            'C30 H26 N P Pt'
_chemical_formula_weight         626.57

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/c'
_space_group_name_Hall           '-P 2ybc'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   9.6029(19)
_cell_length_b                   13.097(3)
_cell_length_c                   19.630(4)
_cell_angle_alpha                90
_cell_angle_beta                 100.17(3)
_cell_angle_gamma                90
_cell_volume                     2430.0(9)
_cell_formula_units_Z            4
_cell_measurement_temperature    298(2)
_cell_measurement_reflns_used    4265
_cell_measurement_theta_min      2.108
_cell_measurement_theta_max      24.996

_exptl_crystal_description       needle
_exptl_crystal_colour            yellow
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.713
_exptl_crystal_F_000             1224
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.500
_exptl_crystal_size_mid          0.300
_exptl_crystal_size_min          0.250
_exptl_absorpt_coefficient_mu    5.859
_shelx_estimated_absorpt_T_min   0.158
_shelx_estimated_absorpt_T_max   0.322
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.1577
_exptl_absorpt_correction_T_max  0.3221
_exptl_absorpt_process_details   'shape of crystal determined optically'
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      298(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   'fine-focus sealed tube'
_diffrn_measurement_device_type  'STOE IPDS 2T'
_diffrn_measurement_method       'rotation method'
_diffrn_detector_area_resol_mean '0.15 mm'
_diffrn_reflns_number            11136
_diffrn_reflns_av_unetI/netI     0.1070
_diffrn_reflns_av_R_equivalents  0.0886
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_theta_min         2.108
_diffrn_reflns_theta_max         24.996
_diffrn_reflns_theta_full        24.996
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measured_fraction_theta_full 0.994
_diffrn_reflns_Laue_measured_fraction_max 0.994
_diffrn_reflns_Laue_measured_fraction_full 0.994
_diffrn_reflns_point_group_measured_fraction_max 0.994
_diffrn_reflns_point_group_measured_fraction_full 0.994
_reflns_number_total             4265
_reflns_number_gt                2745
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_max     .
_reflns_Friedel_fraction_full    .

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       'X-Area (Stoe & Cie GmbH, 2005)'
_computing_cell_refinement       'X-Area (Stoe & Cie GmbH, 2005)'
_computing_data_reduction        'X-Area (Stoe & Cie GmbH, 2005)'
_computing_structure_solution    'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'ORTEP-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX (Farrugia, 1999)'
_refine_special_details          ?
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0394P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         4265
_refine_ls_number_parameters     299
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0730
_refine_ls_R_factor_gt           0.0397
_refine_ls_wR_factor_ref         0.0952
_refine_ls_wR_factor_gt          0.0828
_refine_ls_goodness_of_fit_ref   0.869
_refine_ls_restrained_S_all      0.869
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pt1 Pt 0.22254(4) 0.17607(3) 0.78213(2) 0.03414(12) Uani 1 1 d . . . . .
P1 P 0.1156(3) 0.23210(19) 0.87137(11) 0.0333(5) Uani 1 1 d . . . . .
N1 N 0.2262(8) 0.0183(6) 0.8080(3) 0.0407(19) Uani 1 1 d . . . . .
C1 C 0.3269(11) 0.1193(8) 0.7103(4) 0.043(2) Uani 1 1 d . . . . .
C2 C 0.3856(10) 0.1657(9) 0.6564(4) 0.046(2) Uani 1 1 d . . . . .
H2 H 0.369463 0.235224 0.649284 0.055 Uiso 1 1 calc R U . . .
C3 C 0.4625(13) 0.1184(10) 0.6147(5) 0.060(3) Uani 1 1 d . . . . .
H3 H 0.492630 0.154481 0.579204 0.072 Uiso 1 1 calc R U . . .
C4 C 0.4962(12) 0.0178(11) 0.6244(5) 0.065(3) Uani 1 1 d . . . . .
H4 H 0.552897 -0.014726 0.597242 0.078 Uiso 1 1 calc R U . . .
C5 C 0.4438(10) -0.0350(9) 0.6758(5) 0.053(3) Uani 1 1 d . . . . .
H5 H 0.462630 -0.104436 0.681664 0.063 Uiso 1 1 calc R U . . .
C6 C 0.3642(11) 0.0132(9) 0.7184(4) 0.047(3) Uani 1 1 d . . . . .
C7 C 0.3058(10) -0.0412(8) 0.7719(4) 0.040(2) Uani 1 1 d . . . . .
C8 C 0.3176(12) -0.1459(7) 0.7847(5) 0.050(3) Uani 1 1 d . . . . .
H8 H 0.372034 -0.185579 0.760122 0.061 Uiso 1 1 calc R U . . .
C9 C 0.2517(13) -0.1902(9) 0.8317(5) 0.061(3) Uani 1 1 d . . . . .
H9 H 0.262489 -0.259778 0.840724 0.074 Uiso 1 1 calc R U . . .
C10 C 0.1691(12) -0.1328(8) 0.8660(5) 0.054(3) Uani 1 1 d . . . . .
H10 H 0.119710 -0.162496 0.897624 0.064 Uiso 1 1 calc R U . . .
C11 C 0.1600(11) -0.0318(8) 0.8534(5) 0.047(2) Uani 1 1 d . . . . .
H11 H 0.103774 0.006579 0.877762 0.056 Uiso 1 1 calc R U . . .
C12 C 0.2260(12) 0.3218(8) 0.7448(5) 0.057(3) Uani 1 1 d . . . . .
H12A H 0.317229 0.335590 0.733176 0.086 Uiso 1 1 calc R U . . .
H12B H 0.207982 0.369296 0.779461 0.086 Uiso 1 1 calc R U . . .
H12C H 0.154556 0.328962 0.704191 0.086 Uiso 1 1 calc R U . . .
C13 C 0.2027(9) 0.1724(8) 0.9515(4) 0.037(2) Uani 1 1 d . . . . .
C14 C 0.1343(13) 0.1291(8) 1.0001(4) 0.056(3) Uani 1 1 d . . . . .
H14 H 0.036209 0.132754 0.994603 0.067 Uiso 1 1 calc R U . . .
C15 C 0.2099(13) 0.0803(9) 1.0568(5) 0.061(3) Uani 1 1 d . . . . .
H15 H 0.162493 0.047900 1.088123 0.073 Uiso 1 1 calc R U . . .
C16 C 0.3533(16) 0.0794(9) 1.0672(5) 0.069(4) Uani 1 1 d . . . . .
H16 H 0.403373 0.050077 1.107363 0.083 Uiso 1 1 calc R U . . .
C17 C 0.4262(12) 0.1210(9) 1.0195(5) 0.056(3) Uani 1 1 d . . . . .
H17 H 0.524384 0.117560 1.025693 0.067 Uiso 1 1 calc R U . . .
C18 C 0.3485(11) 0.1680(8) 0.9621(4) 0.049(2) Uani 1 1 d . . . . .
H18 H 0.395911 0.197544 0.929698 0.059 Uiso 1 1 calc R U . . .
C19 C -0.0736(9) 0.2018(7) 0.8628(4) 0.034(2) Uani 1 1 d . . . . .
C20 C -0.1358(10) 0.1361(7) 0.8111(4) 0.041(2) Uani 1 1 d . . . . .
H20 H -0.080935 0.106126 0.782013 0.049 Uiso 1 1 calc R U . . .
C21 C -0.2802(12) 0.1145(9) 0.8024(5) 0.055(3) Uani 1 1 d . . . . .
H21 H -0.321803 0.071984 0.766566 0.066 Uiso 1 1 calc R U . . .
C22 C -0.3598(10) 0.1557(8) 0.8461(5) 0.049(3) Uani 1 1 d . . . . .
H22 H -0.455186 0.139055 0.841270 0.059 Uiso 1 1 calc R U . . .
C23 C -0.2994(11) 0.2226(9) 0.8980(5) 0.053(3) Uani 1 1 d . . . . .
H23 H -0.354521 0.252499 0.927025 0.064 Uiso 1 1 calc R U . . .
C24 C -0.1575(10) 0.2440(8) 0.9060(5) 0.044(2) Uani 1 1 d . . . . .
H24 H -0.116868 0.287794 0.941216 0.053 Uiso 1 1 calc R U . . .
C25 C 0.1168(10) 0.3662(7) 0.8948(4) 0.035(2) Uani 1 1 d . . . . .
C26 C 0.0331(12) 0.4351(8) 0.8501(5) 0.049(3) Uani 1 1 d . . . . .
H26 H -0.023011 0.411364 0.809682 0.059 Uiso 1 1 calc R U . . .
C27 C 0.0342(13) 0.5384(9) 0.8661(5) 0.061(3) Uani 1 1 d . . . . .
H27 H -0.015429 0.583984 0.834435 0.073 Uiso 1 1 calc R U . . .
C28 C 0.1073(11) 0.5742(8) 0.9278(5) 0.049(3) Uani 1 1 d . . . . .
H28 H 0.106155 0.643335 0.938616 0.058 Uiso 1 1 calc R U . . .
C29 C 0.1807(12) 0.5074(8) 0.9724(5) 0.052(3) Uani 1 1 d . . . . .
H29 H 0.226389 0.531192 1.015178 0.063 Uiso 1 1 calc R U . . .
C30 C 0.1909(11) 0.4046(7) 0.9571(5) 0.044(2) Uani 1 1 d . . . . .
H30 H 0.246819 0.361427 0.988253 0.053 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Pt1 C1 2.011(9) . ?
Pt1 C12 2.047(10) . ?
Pt1 N1 2.126(8) . ?
Pt1 P1 2.302(2) . ?
P1 C25 1.815(9) . ?
P1 C13 1.822(8) . ?
P1 C19 1.838(9) . ?
N1 C11 1.352(12) . ?
N1 C7 1.372(11) . ?
C1 C2 1.421(13) . ?
C1 C6 1.436(14) . ?
C2 C3 1.346(14) . ?
C2 H2 0.9300 . ?
C3 C4 1.362(17) . ?
C3 H3 0.9300 . ?
C4 C5 1.389(15) . ?
C4 H4 0.9300 . ?
C5 C6 1.381(13) . ?
C5 H5 0.9300 . ?
C6 C7 1.461(13) . ?
C7 C8 1.395(13) . ?
C8 C9 1.341(15) . ?
C8 H8 0.9300 . ?
C9 C10 1.356(15) . ?
C9 H9 0.9300 . ?
C10 C11 1.346(14) . ?
C10 H10 0.9300 . ?
C11 H11 0.9300 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C13 C14 1.373(13) . ?
C13 C18 1.380(13) . ?
C14 C15 1.374(14) . ?
C14 H14 0.9300 . ?
C15 C16 1.357(17) . ?
C15 H15 0.9300 . ?
C16 C17 1.377(16) . ?
C16 H16 0.9300 . ?
C17 C18 1.381(13) . ?
C17 H17 0.9300 . ?
C18 H18 0.9300 . ?
C19 C20 1.382(12) . ?
C19 C24 1.383(12) . ?
C20 C21 1.396(14) . ?
C20 H20 0.9300 . ?
C21 C22 1.358(14) . ?
C21 H21 0.9300 . ?
C22 C23 1.391(14) . ?
C22 H22 0.9300 . ?
C23 C24 1.372(14) . ?
C23 H23 0.9300 . ?
C24 H24 0.9300 . ?
C25 C30 1.396(12) . ?
C25 C26 1.408(12) . ?
C26 C27 1.388(14) . ?
C26 H26 0.9300 . ?
C27 C28 1.371(13) . ?
C27 H27 0.9300 . ?
C28 C29 1.345(13) . ?
C28 H28 0.9300 . ?
C29 C30 1.387(13) . ?
C29 H29 0.9300 . ?
C30 H30 0.9300 . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 Pt1 C12 93.0(4) . . ?
C1 Pt1 N1 79.5(3) . . ?
C12 Pt1 N1 172.2(3) . . ?
C1 Pt1 P1 174.9(3) . . ?
C12 Pt1 P1 90.7(3) . . ?
N1 Pt1 P1 96.8(2) . . ?
C25 P1 C13 102.4(4) . . ?
C25 P1 C19 101.2(4) . . ?
C13 P1 C19 106.4(4) . . ?
C25 P1 Pt1 121.2(3) . . ?
C13 P1 Pt1 108.7(3) . . ?
C19 P1 Pt1 115.4(3) . . ?
C11 N1 C7 115.7(8) . . ?
C11 N1 Pt1 129.7(6) . . ?
C7 N1 Pt1 114.6(6) . . ?
C2 C1 C6 111.9(9) . . ?
C2 C1 Pt1 132.5(8) . . ?
C6 C1 Pt1 115.2(7) . . ?
C3 C2 C1 126.0(11) . . ?
C3 C2 H2 117.0 . . ?
C1 C2 H2 117.0 . . ?
C2 C3 C4 120.2(11) . . ?
C2 C3 H3 119.9 . . ?
C4 C3 H3 119.9 . . ?
C3 C4 C5 118.4(11) . . ?
C3 C4 H4 120.8 . . ?
C5 C4 H4 120.8 . . ?
C6 C5 C4 121.5(11) . . ?
C6 C5 H5 119.3 . . ?
C4 C5 H5 119.3 . . ?
C5 C6 C1 122.0(10) . . ?
C5 C6 C7 122.4(10) . . ?
C1 C6 C7 115.5(9) . . ?
N1 C7 C8 120.1(9) . . ?
N1 C7 C6 114.4(9) . . ?
C8 C7 C6 125.4(9) . . ?
C9 C8 C7 121.1(10) . . ?
C9 C8 H8 119.5 . . ?
C7 C8 H8 119.5 . . ?
C8 C9 C10 119.4(10) . . ?
C8 C9 H9 120.3 . . ?
C10 C9 H9 120.3 . . ?
C11 C10 C9 118.6(10) . . ?
C11 C10 H10 120.7 . . ?
C9 C10 H10 120.7 . . ?
C10 C11 N1 125.2(10) . . ?
C10 C11 H11 117.4 . . ?
N1 C11 H11 117.4 . . ?
Pt1 C12 H12A 109.5 . . ?
Pt1 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
Pt1 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C14 C13 C18 118.4(9) . . ?
C14 C13 P1 125.0(8) . . ?
C18 C13 P1 116.6(7) . . ?
C13 C14 C15 120.4(11) . . ?
C13 C14 H14 119.8 . . ?
C15 C14 H14 119.8 . . ?
C16 C15 C14 120.3(11) . . ?
C16 C15 H15 119.9 . . ?
C14 C15 H15 119.9 . . ?
C15 C16 C17 121.2(10) . . ?
C15 C16 H16 119.4 . . ?
C17 C16 H16 119.4 . . ?
C16 C17 C18 117.7(11) . . ?
C16 C17 H17 121.1 . . ?
C18 C17 H17 121.1 . . ?
C13 C18 C17 122.0(10) . . ?
C13 C18 H18 119.0 . . ?
C17 C18 H18 119.0 . . ?
C20 C19 C24 118.4(9) . . ?
C20 C19 P1 119.5(7) . . ?
C24 C19 P1 122.1(7) . . ?
C19 C20 C21 120.5(9) . . ?
C19 C20 H20 119.7 . . ?
C21 C20 H20 119.7 . . ?
C22 C21 C20 120.0(10) . . ?
C22 C21 H21 120.0 . . ?
C20 C21 H21 120.0 . . ?
C21 C22 C23 120.3(10) . . ?
C21 C22 H22 119.8 . . ?
C23 C22 H22 119.8 . . ?
C24 C23 C22 119.3(10) . . ?
C24 C23 H23 120.4 . . ?
C22 C23 H23 120.4 . . ?
C23 C24 C19 121.5(9) . . ?
C23 C24 H24 119.2 . . ?
C19 C24 H24 119.2 . . ?
C30 C25 C26 117.6(9) . . ?
C30 C25 P1 123.4(7) . . ?
C26 C25 P1 119.0(7) . . ?
C27 C26 C25 120.2(9) . . ?
C27 C26 H26 119.9 . . ?
C25 C26 H26 119.9 . . ?
C28 C27 C26 121.0(9) . . ?
C28 C27 H27 119.5 . . ?
C26 C27 H27 119.5 . . ?
C29 C28 C27 118.7(10) . . ?
C29 C28 H28 120.7 . . ?
C27 C28 H28 120.7 . . ?
C28 C29 C30 122.7(9) . . ?
C28 C29 H29 118.7 . . ?
C30 C29 H29 118.7 . . ?
C29 C30 C25 119.6(9) . . ?
C29 C30 H30 120.2 . . ?
C25 C30 H30 120.2 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C6 C1 C2 C3 2.6(14) . . . . ?
Pt1 C1 C2 C3 174.9(9) . . . . ?
C1 C2 C3 C4 -3.2(17) . . . . ?
C2 C3 C4 C5 3.0(17) . . . . ?
C3 C4 C5 C6 -2.7(16) . . . . ?
C4 C5 C6 C1 2.4(15) . . . . ?
C4 C5 C6 C7 178.8(9) . . . . ?
C2 C1 C6 C5 -2.1(14) . . . . ?
Pt1 C1 C6 C5 -175.9(7) . . . . ?
C2 C1 C6 C7 -178.8(8) . . . . ?
Pt1 C1 C6 C7 7.5(11) . . . . ?
C11 N1 C7 C8 -1.8(13) . . . . ?
Pt1 N1 C7 C8 179.4(7) . . . . ?
C11 N1 C7 C6 174.1(8) . . . . ?
Pt1 N1 C7 C6 -4.7(9) . . . . ?
C5 C6 C7 N1 -178.2(9) . . . . ?
C1 C6 C7 N1 -1.6(12) . . . . ?
C5 C6 C7 C8 -2.6(15) . . . . ?
C1 C6 C7 C8 174.0(9) . . . . ?
N1 C7 C8 C9 0.2(15) . . . . ?
C6 C7 C8 C9 -175.1(10) . . . . ?
C7 C8 C9 C10 1.9(17) . . . . ?
C8 C9 C10 C11 -2.3(17) . . . . ?
C9 C10 C11 N1 0.7(17) . . . . ?
C7 N1 C11 C10 1.3(15) . . . . ?
Pt1 N1 C11 C10 179.9(8) . . . . ?
C25 P1 C13 C14 95.9(10) . . . . ?
C19 P1 C13 C14 -9.9(10) . . . . ?
Pt1 P1 C13 C14 -134.7(9) . . . . ?
C25 P1 C13 C18 -86.4(9) . . . . ?
C19 P1 C13 C18 167.9(8) . . . . ?
Pt1 P1 C13 C18 43.0(9) . . . . ?
C18 C13 C14 C15 -1.7(16) . . . . ?
P1 C13 C14 C15 176.0(8) . . . . ?
C13 C14 C15 C16 3.6(18) . . . . ?
C14 C15 C16 C17 -4.2(19) . . . . ?
C15 C16 C17 C18 2.9(18) . . . . ?
C14 C13 C18 C17 0.5(16) . . . . ?
P1 C13 C18 C17 -177.4(8) . . . . ?
C16 C17 C18 C13 -1.1(16) . . . . ?
C25 P1 C19 C20 142.3(7) . . . . ?
C13 P1 C19 C20 -111.1(8) . . . . ?
Pt1 P1 C19 C20 9.6(8) . . . . ?
C25 P1 C19 C24 -36.7(8) . . . . ?
C13 P1 C19 C24 70.0(9) . . . . ?
Pt1 P1 C19 C24 -169.4(7) . . . . ?
C24 C19 C20 C21 1.0(14) . . . . ?
P1 C19 C20 C21 -178.0(7) . . . . ?
C19 C20 C21 C22 -2.0(15) . . . . ?
C20 C21 C22 C23 2.5(16) . . . . ?
C21 C22 C23 C24 -2.1(16) . . . . ?
C22 C23 C24 C19 1.1(16) . . . . ?
C20 C19 C24 C23 -0.5(15) . . . . ?
P1 C19 C24 C23 178.4(8) . . . . ?
C13 P1 C25 C30 9.0(9) . . . . ?
C19 P1 C25 C30 118.7(9) . . . . ?
Pt1 P1 C25 C30 -112.2(8) . . . . ?
C13 P1 C25 C26 -167.5(8) . . . . ?
C19 P1 C25 C26 -57.7(9) . . . . ?
Pt1 P1 C25 C26 71.3(9) . . . . ?
C30 C25 C26 C27 4.6(16) . . . . ?
P1 C25 C26 C27 -178.7(9) . . . . ?
C25 C26 C27 C28 -5.1(18) . . . . ?
C26 C27 C28 C29 1.2(18) . . . . ?
C27 C28 C29 C30 3.1(17) . . . . ?
C28 C29 C30 C25 -3.5(17) . . . . ?
C26 C25 C30 C29 -0.4(15) . . . . ?
P1 C25 C30 C29 -176.9(8) . . . . ?

_refine_diff_density_max         2.123
_refine_diff_density_min         -1.267
_refine_diff_density_rms         0.180

