# Supplementary Information (SI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2025

####################################################################### 
# 
# 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_sun06
_database_code_depnum_ccdc_archive 'CCDC 1821529'
loop_
_audit_author_name
_audit_author_address
li
;shandong university
China
;
_audit_update_record             
;
2025-05-05 deposited with the CCDC.	2025-06-06 downloaded from the CCDC.
;
_audit_creation_date             2025-05-05
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         'C41 H43 Cl Co N2 P3 Si'
_chemical_formula_sum            'C41 H43 Cl Co N2 P3 Si'
_chemical_formula_weight         779.15
_chemical_melting_point          ?
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'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co 0.3494 0.9721 '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'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      tetragonal
_space_group_IT_number           87
_space_group_name_H-M_alt        'I 4/m'
_space_group_name_Hall           '-I 4'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x, z'
'-x, -y, z'
'y, -x, z'
'x+1/2, y+1/2, z+1/2'
'-y+1/2, x+1/2, z+1/2'
'-x+1/2, -y+1/2, z+1/2'
'y+1/2, -x+1/2, z+1/2'
'-x, -y, -z'
'y, -x, -z'
'x, y, -z'
'-y, x, -z'
'-x+1/2, -y+1/2, -z+1/2'
'y+1/2, -x+1/2, -z+1/2'
'x+1/2, y+1/2, -z+1/2'
'-y+1/2, x+1/2, -z+1/2'

_cell_length_a                   20.9609(9)
_cell_length_b                   20.9609(9)
_cell_length_c                   17.7989(7)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     7820.1(7)
_cell_formula_units_Z            8
_cell_measurement_reflns_used    73253
_cell_measurement_temperature    150.15
_cell_measurement_theta_max      35.44
_cell_measurement_theta_min      1.50
_shelx_estimated_absorpt_T_max   0.868
_shelx_estimated_absorpt_T_min   0.857
_exptl_absorpt_coefficient_mu    0.692
_exptl_absorpt_correction_T_max  0.7885
_exptl_absorpt_correction_T_min  0.5115
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
STOE X-Red32, absorption correction by Gaussian integration, analogous to
P. Coppens, "The Evaluation of Absorption and Extinction in Single-Crystal
Structure Analysis", published in: F. R. Ahmed (Editor), "Crystallographic
Computing", Munksgaard, Copenhagen (1970), 255 - 270.
Afterwards scaling of reflection intensities was performed within STOE LANA.
J. Koziskova, F. Hahn, J. Richter, J. Kozisek, "Comparison of different
absorption corrections on the model structure of tetrakis(μ₂-acetato)-
diaqua-di-copper(II)", Acta Chimica Slovaca, vol. 9, no. 2, 2016, pp. 136 - 140.
Finally a spherical absorption correction was done within STOE LANA.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'yellowish orange'
_exptl_crystal_colour_modifier   yellowish
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    1.324
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       cube
_exptl_crystal_F_000             3248
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
1 4 4 0.0975
-1 -4 -4 0.0975
1 4 -3 0.1023
-1 -4 3 0.1023
4 -1 0 0.1153
-4 1 0 0.1153

_exptl_crystal_size_max          0.23
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.21
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0539
_diffrn_reflns_av_unetI/netI     0.0327
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.998
_diffrn_reflns_limit_h_max       ?
_diffrn_reflns_limit_h_min       ?
_diffrn_reflns_limit_k_max       ?
_diffrn_reflns_limit_k_min       ?
_diffrn_reflns_limit_l_max       ?
_diffrn_reflns_limit_l_min       ?
_diffrn_reflns_number            7257
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.998
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         32.492
_diffrn_reflns_theta_min         1.501
_diffrn_ambient_temperature      150.15
_diffrn_detector_area_resol_mean 5.81
_diffrn_detector_type            DECTRIS
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device       '4-circle goniometer'
_diffrn_measurement_device_type  'Stoe StadiVari'
_diffrn_measurement_method       'rotation method'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                5400
_reflns_number_total             7257
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       ?
_computing_data_collection       'CrysAlisPro 1.171.40.25a (Rigaku OD, 2017)'
_computing_data_reduction        'CrysAlisPro 1.171.40.25a (Rigaku OD, 2017)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'ShelXS (Sheldrick, 2008)'
_refine_diff_density_max         0.700
_refine_diff_density_min         -0.670
_refine_diff_density_rms         0.073
_refine_ls_extinction_coef       .
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.047
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     251
_refine_ls_number_reflns         7257
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0628
_refine_ls_R_factor_gt           0.0391
_refine_ls_restrained_S_all      1.047
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0576P)²+1.7954P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0949
_refine_ls_wR_factor_ref         0.1027
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2. Others
 Fixed Sof: H24A(0.5) H24B(0.5) H24C(0.5)
3.a Secondary CH2 refined with riding coordinates:
 C10(H10A,H10B)
3.b Aromatic/amide H refined with riding coordinates:
 C2(H2), C3(H3), C4(H4), C5(H5), C6(H6), C12(H12), C13(H13), C14(H14),
 C15(H15), C16(H16), C18(H18), C19(H19), C20(H20), C21(H21), C22(H22)
3.c Idealised Me refined as rotating group:
 C23(H23A,H23B,H23C), C24(H24A,H24B,H24C)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
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
Co1 Co 0.74798(2) 0.35065(2) 0.500000 0.01562(6) Uani 1 2 d S T P . .
H H 0.8130(14) 0.3745(14) 0.500000 0.039(8) Uiso 1 2 d S . P . .
Cl1 Cl 0.64314(2) 0.31622(2) 0.500000 0.01985(9) Uani 1 2 d S T P . .
P1 P 0.75336(2) 0.32794(2) 0.37943(2) 0.01754(8) Uani 1 1 d . . . . .
P2 P 0.72475(3) 0.45504(2) 0.500000 0.01997(10) Uani 1 2 d S T P . .
Si1 Si 0.78135(2) 0.24844(3) 0.500000 0.01673(11) Uani 1 2 d S T P . .
N1 N 0.74139(6) 0.20617(5) 0.42799(6) 0.0194(2) Uani 1 1 d . . . . .
C1 C 0.86827(10) 0.22712(10) 0.500000 0.0219(4) Uani 1 2 d S T P . .
C2 C 0.88394(15) 0.16334(14) 0.500000 0.0702(12) Uani 1 2 d S T P . .
H2 H 0.851022 0.132181 0.500000 0.084 Uiso 1 2 calc R U P . .
C3 C 0.94695(17) 0.14415(19) 0.500000 0.0906(16) Uani 1 2 d S T P . .
H3 H 0.956672 0.099881 0.500000 0.109 Uiso 1 2 calc R U P . .
C4 C 0.99473(14) 0.18674(18) 0.500000 0.0523(8) Uani 1 2 d S T P . .
H4 H 1.037798 0.172609 0.500000 0.063 Uiso 1 2 calc R U P . .
C5 C 0.98122(12) 0.25053(15) 0.500000 0.0395(6) Uani 1 2 d S T P . .
H5 H 1.014746 0.281026 0.500000 0.047 Uiso 1 2 calc R U P . .
C6 C 0.91779(11) 0.27037(12) 0.500000 0.0303(5) Uani 1 2 d S T P . .
H6 H 0.908464 0.314718 0.500000 0.036 Uiso 1 2 calc R U P . .
C7 C 0.60555(8) 0.09355(8) 0.46111(11) 0.0324(3) Uani 1 1 d . . . . .
H7 H 0.5773(9) 0.0675(9) 0.4306(10) 0.030(5) Uiso 1 1 d . . . . .
C8 C 0.65034(7) 0.12969(7) 0.42143(9) 0.0261(3) Uani 1 1 d . . . . .
H8 H 0.6502(10) 0.1301(10) 0.3664(12) 0.036(5) Uiso 1 1 d . . . . .
C9 C 0.69559(7) 0.16529(6) 0.46010(8) 0.0203(3) Uani 1 1 d . . . . .
C10 C 0.72238(7) 0.24534(7) 0.36426(8) 0.0204(3) Uani 1 1 d . . . . .
H10A H 0.675293 0.246109 0.359952 0.024 Uiso 1 1 calc R U . . .
H10B H 0.740129 0.227449 0.317219 0.024 Uiso 1 1 calc R U . . .
C11 C 0.70636(7) 0.37000(7) 0.30757(8) 0.0219(3) Uani 1 1 d . . . . .
C12 C 0.73328(9) 0.39280(7) 0.24149(9) 0.0286(3) Uani 1 1 d . . . . .
H12 H 0.777881 0.388569 0.233440 0.034 Uiso 1 1 calc R U . . .
C13 C 0.69551(10) 0.42177(9) 0.18697(10) 0.0392(4) Uani 1 1 d . . . . .
H13 H 0.714420 0.437260 0.142028 0.047 Uiso 1 1 calc R U . . .
C14 C 0.63077(10) 0.42804(10) 0.19803(11) 0.0427(5) Uani 1 1 d . . . . .
H14 H 0.605108 0.447775 0.160674 0.051 Uiso 1 1 calc R U . . .
C15 C 0.60311(9) 0.40566(9) 0.26335(10) 0.0389(4) Uani 1 1 d . . . . .
H15 H 0.558441 0.409997 0.270809 0.047 Uiso 1 1 calc R U . . .
C16 C 0.64056(8) 0.37676(8) 0.31830(9) 0.0300(3) Uani 1 1 d . . . . .
H16 H 0.621366 0.361584 0.363225 0.036 Uiso 1 1 calc R U . . .
C17 C 0.83387(7) 0.32710(7) 0.33974(8) 0.0220(3) Uani 1 1 d . . . . .
C18 C 0.86233(8) 0.27253(8) 0.31007(9) 0.0278(3) Uani 1 1 d . . . . .
H18 H 0.839185 0.233587 0.308658 0.033 Uiso 1 1 calc R U . . .
C19 C 0.92417(9) 0.27469(10) 0.28260(11) 0.0388(4) Uani 1 1 d . . . . .
H19 H 0.943113 0.237178 0.262616 0.047 Uiso 1 1 calc R U . . .
C20 C 0.95840(9) 0.33079(11) 0.28403(12) 0.0457(5) Uani 1 1 d . . . . .
H20 H 1.000483 0.332145 0.264292 0.055 Uiso 1 1 calc R U . . .
C21 C 0.93127(9) 0.38499(10) 0.31427(12) 0.0451(5) Uani 1 1 d . . . . .
H21 H 0.954885 0.423654 0.315816 0.054 Uiso 1 1 calc R U . . .
C22 C 0.86962(8) 0.38315(8) 0.34240(11) 0.0343(4) Uani 1 1 d . . . . .
H22 H 0.851521 0.420531 0.363760 0.041 Uiso 1 1 calc R U . . .
C23 C 0.75420(10) 0.50265(8) 0.42143(10) 0.0347(4) Uani 1 1 d . . . . .
H23A H 0.738187 0.484807 0.374160 0.052 Uiso 1 1 calc R U . . .
H23B H 0.800947 0.501969 0.421203 0.052 Uiso 1 1 calc R U . . .
H23C H 0.739270 0.546722 0.426753 0.052 Uiso 1 1 calc R U . . .
C24 C 0.64028(11) 0.47516(11) 0.500000 0.0349(5) Uani 1 2 d S T P . .
H24A H 0.621074 0.461815 0.547677 0.052 Uiso 0.5 1 calc R U P A -1
H24B H 0.619010 0.453151 0.458379 0.052 Uiso 0.5 1 calc R U P A -1
H24C H 0.635261 0.521363 0.493944 0.052 Uiso 0.5 1 calc R U P A -1


_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
Co1 H 1.45(3) . ?
Co1 Cl1 2.3129(5) . ?
Co1 P1 2.2010(4) 11_556 ?
Co1 P1 2.2011(4) . ?
Co1 P2 2.2415(6) . ?
Co1 Si1 2.2538(6) . ?
P1 C10 1.8687(14) . ?
P1 C11 1.8395(15) . ?
P1 C17 1.8295(15) . ?
P2 C23 1.8254(16) 11_556 ?
P2 C23 1.8255(16) . ?
P2 C24 1.820(2) . ?
Si1 N1 1.7690(12) . ?
Si1 N1 1.7689(12) 11_556 ?
Si1 C1 1.876(2) . ?
N1 C9 1.4080(18) . ?
N1 C10 1.4559(18) . ?
C1 C2 1.377(3) . ?
C1 C6 1.378(3) . ?
C2 H2 0.9500 . ?
C2 C3 1.381(4) . ?
C3 H3 0.9500 . ?
C3 C4 1.342(5) . ?
C4 H4 0.9500 . ?
C4 C5 1.367(5) . ?
C5 H5 0.9500 . ?
C5 C6 1.393(3) . ?
C6 H6 0.9500 . ?
C7 C7 1.384(4) 11_556 ?
C7 H7 0.97(2) . ?
C7 C8 1.398(2) . ?
C8 H8 0.98(2) . ?
C8 C9 1.389(2) . ?
C9 C9 1.420(3) 11_556 ?
C10 H10A 0.9900 . ?
C10 H10B 0.9900 . ?
C11 C12 1.389(2) . ?
C11 C16 1.400(2) . ?
C12 H12 0.9500 . ?
C12 C13 1.392(2) . ?
C13 H13 0.9500 . ?
C13 C14 1.377(3) . ?
C14 H14 0.9500 . ?
C14 C15 1.381(3) . ?
C15 H15 0.9500 . ?
C15 C16 1.393(2) . ?
C16 H16 0.9500 . ?
C17 C18 1.394(2) . ?
C17 C22 1.394(2) . ?
C18 H18 0.9500 . ?
C18 C19 1.386(2) . ?
C19 H19 0.9500 . ?
C19 C20 1.378(3) . ?
C20 H20 0.9500 . ?
C20 C21 1.380(3) . ?
C21 H21 0.9500 . ?
C21 C22 1.386(2) . ?
C22 H22 0.9500 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?

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
Cl1 Co1 H 178.1(12) . . ?
P1 Co1 H 91.5(3) 11_556 . ?
P1 Co1 H 91.5(3) . . ?
P1 Co1 Cl1 88.922(11) . . ?
P1 Co1 Cl1 88.921(11) 11_556 . ?
P1 Co1 P1 154.31(2) 11_556 . ?
P1 Co1 P2 102.842(11) 11_556 . ?
P1 Co1 P2 102.843(11) . . ?
P1 Co1 Si1 77.200(11) . . ?
P1 Co1 Si1 77.201(11) 11_556 . ?
P2 Co1 H 82.4(12) . . ?
P2 Co1 Cl1 95.64(2) . . ?
P2 Co1 Si1 174.46(2) . . ?
Si1 Co1 H 92.0(12) . . ?
Si1 Co1 Cl1 89.90(2) . . ?
C10 P1 Co1 108.87(5) . . ?
C11 P1 Co1 123.14(5) . . ?
C11 P1 C10 99.07(6) . . ?
C17 P1 Co1 115.20(5) . . ?
C17 P1 C10 104.83(7) . . ?
C17 P1 C11 103.31(7) . . ?
C23 P2 Co1 117.40(6) . . ?
C23 P2 Co1 117.40(6) 11_556 . ?
C23 P2 C23 100.00(12) 11_556 . ?
C24 P2 Co1 115.94(8) . . ?
C24 P2 C23 101.67(8) . . ?
C24 P2 C23 101.67(8) . 11_556 ?
N1 Si1 Co1 109.22(4) 11_556 . ?
N1 Si1 Co1 109.22(4) . . ?
N1 Si1 N1 92.86(8) 11_556 . ?
N1 Si1 C1 109.91(6) 11_556 . ?
N1 Si1 C1 109.91(6) . . ?
C1 Si1 Co1 121.86(7) . . ?
C9 N1 Si1 109.49(9) . . ?
C9 N1 C10 118.22(11) . . ?
C10 N1 Si1 114.31(9) . . ?
C2 C1 Si1 117.58(18) . . ?
C2 C1 C6 117.3(2) . . ?
C6 C1 Si1 125.09(17) . . ?
C1 C2 H2 119.6 . . ?
C1 C2 C3 120.7(3) . . ?
C3 C2 H2 119.6 . . ?
C2 C3 H3 119.3 . . ?
C4 C3 C2 121.4(3) . . ?
C4 C3 H3 119.3 . . ?
C3 C4 H4 120.1 . . ?
C3 C4 C5 119.8(3) . . ?
C5 C4 H4 120.1 . . ?
C4 C5 H5 120.3 . . ?
C4 C5 C6 119.3(3) . . ?
C6 C5 H5 120.3 . . ?
C1 C6 C5 121.5(2) . . ?
C1 C6 H6 119.2 . . ?
C5 C6 H6 119.2 . . ?
C7 C7 H7 124.0(11) 11_556 . ?
C7 C7 C8 120.34(10) 11_556 . ?
C8 C7 H7 115.6(11) . . ?
C7 C8 H8 120.6(12) . . ?
C9 C8 C7 119.95(15) . . ?
C9 C8 H8 119.5(12) . . ?
N1 C9 C9 113.95(8) . 11_556 ?
C8 C9 N1 126.24(14) . . ?
C8 C9 C9 119.70(9) . 11_556 ?
P1 C10 H10A 110.0 . . ?
P1 C10 H10B 110.0 . . ?
N1 C10 P1 108.35(9) . . ?
N1 C10 H10A 110.0 . . ?
N1 C10 H10B 110.0 . . ?
H10A C10 H10B 108.4 . . ?
C12 C11 P1 122.41(12) . . ?
C12 C11 C16 118.74(14) . . ?
C16 C11 P1 118.78(11) . . ?
C11 C12 H12 119.7 . . ?
C11 C12 C13 120.62(17) . . ?
C13 C12 H12 119.7 . . ?
C12 C13 H13 119.9 . . ?
C14 C13 C12 120.16(17) . . ?
C14 C13 H13 119.9 . . ?
C13 C14 H14 120.0 . . ?
C13 C14 C15 120.09(16) . . ?
C15 C14 H14 120.0 . . ?
C14 C15 H15 119.9 . . ?
C14 C15 C16 120.15(18) . . ?
C16 C15 H15 119.9 . . ?
C11 C16 H16 119.9 . . ?
C15 C16 C11 120.24(16) . . ?
C15 C16 H16 119.9 . . ?
C18 C17 P1 123.30(12) . . ?
C18 C17 C22 118.30(14) . . ?
C22 C17 P1 118.34(11) . . ?
C17 C18 H18 119.8 . . ?
C19 C18 C17 120.47(16) . . ?
C19 C18 H18 119.8 . . ?
C18 C19 H19 119.7 . . ?
C20 C19 C18 120.55(17) . . ?
C20 C19 H19 119.7 . . ?
C19 C20 H20 120.2 . . ?
C19 C20 C21 119.70(17) . . ?
C21 C20 H20 120.2 . . ?
C20 C21 H21 119.9 . . ?
C20 C21 C22 120.13(18) . . ?
C22 C21 H21 119.9 . . ?
C17 C22 H22 119.6 . . ?
C21 C22 C17 120.81(16) . . ?
C21 C22 H22 119.6 . . ?
P2 C23 H23A 109.5 . . ?
P2 C23 H23B 109.5 . . ?
P2 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
P2 C24 H24A 109.5 . . ?
P2 C24 H24B 109.5 . . ?
P2 C24 H24C 109.5 . . ?
H24A C24 H24B 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?

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
Co1 P1 C10 N1 -36.13(10) . . . . ?
Co1 P1 C11 C12 132.64(11) . . . . ?
Co1 P1 C11 C16 -50.32(14) . . . . ?
Co1 P1 C17 C18 116.30(12) . . . . ?
Co1 P1 C17 C22 -60.68(14) . . . . ?
Co1 Si1 N1 C9 -106.78(9) . . . . ?
Co1 Si1 N1 C10 28.46(10) . . . . ?
Co1 Si1 C1 C2 180.0 . . . . ?
Co1 Si1 C1 C6 0.0 . . . . ?
P1 C11 C12 C13 177.01(13) . . . . ?
P1 C11 C16 C15 -176.94(14) . . . . ?
P1 C17 C18 C19 -178.30(13) . . . . ?
P1 C17 C22 C21 178.96(16) . . . . ?
Si1 N1 C9 C8 172.61(12) . . . . ?
Si1 N1 C9 C9 -3.55(9) . . . 11_556 ?
Si1 N1 C10 P1 4.06(12) . . . . ?
Si1 C1 C2 C3 180.0 . . . . ?
Si1 C1 C6 C5 180.0 . . . . ?
N1 Si1 N1 C9 4.71(12) 11_556 . . . ?
N1 Si1 N1 C10 139.96(8) 11_556 . . . ?
N1 Si1 C1 C2 -50.41(5) . . . . ?
N1 Si1 C1 C2 50.40(5) 11_556 . . . ?
N1 Si1 C1 C6 -129.60(5) 11_556 . . . ?
N1 Si1 C1 C6 129.59(5) . . . . ?
C1 Si1 N1 C9 117.09(10) . . . . ?
C1 Si1 N1 C10 -107.66(11) . . . . ?
C1 C2 C3 C4 0.0 . . . . ?
C2 C1 C6 C5 0.0 . . . . ?
C2 C3 C4 C5 0.0 . . . . ?
C3 C4 C5 C6 0.0 . . . . ?
C4 C5 C6 C1 0.0 . . . . ?
C6 C1 C2 C3 0.0 . . . . ?
C7 C7 C8 C9 0.71(18) 11_556 . . . ?
C7 C8 C9 N1 -176.67(14) . . . . ?
C7 C8 C9 C9 -0.71(18) . . . 11_556 ?
C9 N1 C10 P1 135.18(11) . . . . ?
C10 P1 C11 C12 -107.66(13) . . . . ?
C10 P1 C11 C16 69.38(13) . . . . ?
C10 P1 C17 C18 -3.33(15) . . . . ?
C10 P1 C17 C22 179.69(13) . . . . ?
C10 N1 C9 C8 39.3(2) . . . . ?
C10 N1 C9 C9 -136.81(9) . . . 11_556 ?
C11 P1 C10 N1 -165.89(10) . . . . ?
C11 P1 C17 C18 -106.63(14) . . . . ?
C11 P1 C17 C22 76.39(14) . . . . ?
C11 C12 C13 C14 -0.1(3) . . . . ?
C12 C11 C16 C15 0.2(2) . . . . ?
C12 C13 C14 C15 0.1(3) . . . . ?
C13 C14 C15 C16 0.1(3) . . . . ?
C14 C15 C16 C11 -0.2(3) . . . . ?
C16 C11 C12 C13 0.0(2) . . . . ?
C17 P1 C10 N1 87.65(10) . . . . ?
C17 P1 C11 C12 0.03(14) . . . . ?
C17 P1 C11 C16 177.08(12) . . . . ?
C17 C18 C19 C20 -0.1(3) . . . . ?
C18 C17 C22 C21 1.8(3) . . . . ?
C18 C19 C20 C21 1.1(3) . . . . ?
C19 C20 C21 C22 -0.6(3) . . . . ?
C20 C21 C22 C17 -0.9(3) . . . . ?
C22 C17 C18 C19 -1.3(2) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
####################################################################### 
# 
# 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_191212c
_database_code_depnum_ccdc_archive 'CCDC 1972113'
loop_
_audit_author_name
_audit_author_address
li
;shandong university
China
;
_audit_update_record             
;
2025-05-05 deposited with the CCDC.	2025-06-06 downloaded from the CCDC.
;
_audit_creation_date             2025-05-05
_audit_creation_method           
;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
_shelx_SHELXL_version_number     2018/3
_chemical_name_common            ?
_chemical_name_systematic        
;
 ?
;
_chemical_formula_moiety         'C24 H49 Cl Co N2 P3 Si'
_chemical_formula_sum            'C24 H49 Cl Co N2 P3 Si'
_chemical_formula_weight         581.03
_chemical_melting_point          ?
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co -2.3653 3.6143 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.2541 0.3302 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_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.
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
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                   15.4377(3)
_cell_length_b                   10.88817(18)
_cell_length_c                   18.2030(3)
_cell_angle_alpha                90
_cell_angle_beta                 107.2747(18)
_cell_angle_gamma                90
_cell_volume                     2921.70(9)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    9610
_cell_measurement_temperature    173
_cell_measurement_theta_max      75.7230
_cell_measurement_theta_min      2.9660
_shelx_estimated_absorpt_T_max   0.662
_shelx_estimated_absorpt_T_min   0.552
_exptl_absorpt_coefficient_mu    7.501
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.16940
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
;
CrysAlisPro 1.171.40.25a (Rigaku Oxford Diffraction, 2018)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_absorpt_special_details   ?
_exptl_crystal_colour            'clear light orange'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   light
_exptl_crystal_colour_primary    orange
_exptl_crystal_density_diffrn    1.321
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_description       block
_exptl_crystal_F_000             1240
_exptl_crystal_size_max          0.09
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.06
_exptl_special_details           
;
 ?
;
_exptl_transmission_factor_max   ?
_exptl_transmission_factor_min   ?
_diffrn_reflns_av_R_equivalents  0.0515
_diffrn_reflns_av_unetI/netI     0.0511
_diffrn_reflns_Laue_measured_fraction_full 0.988
_diffrn_reflns_Laue_measured_fraction_max 0.940
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -5
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            17586
_diffrn_reflns_point_group_measured_fraction_full 0.988
_diffrn_reflns_point_group_measured_fraction_max 0.940
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         76.251
_diffrn_reflns_theta_min         2.998
_diffrn_ambient_temperature      173
_diffrn_detector_area_resol_mean 10.0000
_diffrn_detector_type            HyPix
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.940
_diffrn_measurement_details      
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω    -85.00  -1.00   1.00    0.10    --  -48.45 113.00-158.00   84
  2  ω     32.00  57.00   1.00    0.10    --   48.45-113.00 109.00   25
  3  ω   -143.00-118.00   1.00    0.45    --  -86.25-113.00 109.00   25
  4  ω    -87.00 -14.00   1.00    0.45    --  -86.25 113.00-158.00   73
  5  ω    114.00 139.00   1.00    0.45    --  106.49 113.00-158.00   25
  6  ω     37.00 112.00   1.00    0.45    --  106.49-113.00 109.00   75
  7  ω   -119.00 -70.00   1.00    0.10    --  -48.45-125.00 150.00   49
  8  ω   -120.00 -33.00   1.00    0.10    --  -48.45 -57.00  90.00   87
  9  ω   -155.00 -84.00   1.00    0.45    --  -86.25 -99.00-120.00   71
 10  ω     34.00 117.00   1.00    0.45    --  106.49-125.00 -30.00   83
 11  ω     93.00 173.00   1.00    0.45    --  106.49 125.00-180.00   80
 12  ω     97.00 177.00   1.00    0.45    --  106.49  57.00 120.00   80
 13  ω     34.00 109.00   1.00    0.45    --  106.49 -99.00 -30.00   75
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy, Dualflex, HyPix'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_source                   ?
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                5081
_reflns_number_total             5761
_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.
;
_reflns_threshold_expression     'I > 2σ(I)'
_computing_cell_refinement       'CrysAlisPro 1.171.40.25a (Rigaku OD, 2018)'
_computing_data_collection       'CrysAlisPro 1.171.40.25a (Rigaku OD, 2018)'
_computing_data_reduction        'CrysAlisPro 1.171.40.25a (Rigaku OD, 2018)'
_computing_molecular_graphics    'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 1.3 (Dolomanov et al., 2009)'
_computing_structure_refinement  'SHELXL 2018/3 (Sheldrick, 2015)'
_computing_structure_solution    'olex2.solve 1.3 (Bourhis et al., 2015)'
_refine_diff_density_max         1.175
_refine_diff_density_min         -0.731
_refine_diff_density_rms         0.121
_refine_ls_extinction_coef       0.00066(11)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2018/3 (Sheldrick 2018)'
_refine_ls_goodness_of_fit_ref   1.057
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     306
_refine_ls_number_reflns         5761
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0673
_refine_ls_R_factor_gt           0.0546
_refine_ls_restrained_S_all      1.057
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0753P)²+9.5001P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1394
_refine_ls_wR_factor_ref         0.1537
_refine_special_details          ?
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C9(H9), C16(H16), C12(H12), C19(H19)
2.b Secondary CH2 refined with riding coordinates:
 C7(H7A,H7B), C14(H14A,H14B)
2.c Aromatic/amide H refined with riding coordinates:
 C6(H6), C2(H2), C3(H3), C1(H1)
2.d Idealised Me refined as rotating group:
 C11(H11A,H11B,H11C), C20(H20A,H20B,H20C), C17(H17A,H17B,H17C), C22(H22A,H22B,
 H22C), C23(H23A,H23B,H23C), C13(H13A,H13B,H13C), C21(H21A,H21B,H21C), C8(H8A,
 H8B,H8C), C15(H15A,H15B,H15C), C10(H10A,H10B,H10C), C18(H18A,H18B,H18C),
 C24(H24A,H24B,H24C)
;
_atom_sites_solution_hydrogens   mixed
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   ?
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
Co1 Co 0.28260(4) 0.09066(5) 0.58221(3) 0.01036(17) Uani 1 1 d . . . . .
P3 P 0.22864(6) -0.07939(8) 0.62258(5) 0.0121(2) Uani 1 1 d . . . . .
Cl1 Cl 0.43650(6) 0.05131(9) 0.63524(5) 0.0194(2) Uani 1 1 d . . . . .
P1 P 0.28656(6) 0.29281(8) 0.56431(5) 0.0134(2) Uani 1 1 d . . . . .
Si1 Si 0.26209(7) 0.15476(9) 0.69264(5) 0.0120(2) Uani 1 1 d . . . . .
P2 P 0.30034(7) 0.02753(10) 0.46712(6) 0.0196(2) Uani 1 1 d . . . . .
N1 N 0.1675(2) 0.0816(3) 0.71034(18) 0.0137(6) Uani 1 1 d . . . . .
N2 N 0.2077(2) 0.2994(3) 0.68048(19) 0.0161(7) Uani 1 1 d . . . . .
C5 C 0.0981(2) 0.1670(3) 0.7051(2) 0.0133(7) Uani 1 1 d . . . . .
C6 C 0.0122(3) 0.1409(4) 0.7115(2) 0.0171(8) Uani 1 1 d . . . . .
H6 H -0.002899 0.059691 0.722293 0.021 Uiso 1 1 calc R U . . .
C4 C 0.1200(3) 0.2879(3) 0.6884(2) 0.0149(7) Uani 1 1 d . . . . .
C7 C 0.2186(3) 0.3768(4) 0.6186(2) 0.0215(8) Uani 1 1 d . . . . .
H7A H 0.250095 0.453816 0.640277 0.026 Uiso 1 1 calc R U . . .
H7B H 0.158361 0.398477 0.583256 0.026 Uiso 1 1 calc R U . . .
C14 C 0.1438(3) -0.0374(3) 0.6734(2) 0.0182(8) Uani 1 1 d . . . . .
H14A H 0.082322 -0.033711 0.636043 0.022 Uiso 1 1 calc R U . . .
H14B H 0.143440 -0.100509 0.712467 0.022 Uiso 1 1 calc R U . . .
C2 C -0.0302(3) 0.3531(4) 0.6843(2) 0.0230(9) Uani 1 1 d . . . . .
H2 H -0.074583 0.416034 0.676484 0.028 Uiso 1 1 calc R U . . .
C3 C 0.0558(3) 0.3808(4) 0.6780(2) 0.0220(8) Uani 1 1 d . . . . .
H3 H 0.070134 0.462169 0.666816 0.026 Uiso 1 1 calc R U . . .
C1 C -0.0515(3) 0.2358(4) 0.7017(2) 0.0215(8) Uani 1 1 d . . . . .
H1 H -0.109759 0.219199 0.707106 0.026 Uiso 1 1 calc R U . . .
C11 C 0.4353(3) 0.3741(4) 0.6840(3) 0.0301(10) Uani 1 1 d . . . . .
H11A H 0.389329 0.391882 0.709883 0.045 Uiso 1 1 calc R U . . .
H11B H 0.485249 0.433008 0.701025 0.045 Uiso 1 1 calc R U . . .
H11C H 0.458559 0.290613 0.697042 0.045 Uiso 1 1 calc R U . . .
C20 C 0.3622(3) -0.2665(4) 0.6570(3) 0.0315(10) Uani 1 1 d . . . . .
H20A H 0.315537 -0.325049 0.629608 0.047 Uiso 1 1 calc R U . . .
H20B H 0.409272 -0.309810 0.696619 0.047 Uiso 1 1 calc R U . . .
H20C H 0.389310 -0.227656 0.620507 0.047 Uiso 1 1 calc R U . . .
C9 C 0.2337(3) 0.3510(4) 0.4645(2) 0.0213(8) Uani 1 1 d . . . . .
H9 H 0.263548 0.305587 0.430889 0.026 Uiso 1 1 calc R U . . .
C17 C 0.1218(3) -0.2986(4) 0.5931(3) 0.0317(10) Uani 1 1 d . . . . .
H17A H 0.172250 -0.341996 0.629379 0.048 Uiso 1 1 calc R U . . .
H17B H 0.087208 -0.356311 0.553991 0.048 Uiso 1 1 calc R U . . .
H17C H 0.082097 -0.263589 0.620793 0.048 Uiso 1 1 calc R U . . .
C16 C 0.1596(3) -0.1945(4) 0.5537(2) 0.0212(8) Uani 1 1 d . . . . .
H16 H 0.200046 -0.233111 0.526342 0.025 Uiso 1 1 calc R U . . .
C22 C 0.3941(3) 0.0997(4) 0.4411(3) 0.0270(9) Uani 1 1 d . . . . .
H22A H 0.449406 0.095047 0.484845 0.040 Uiso 1 1 calc R U . . .
H22B H 0.379411 0.185902 0.427686 0.040 Uiso 1 1 calc R U . . .
H22C H 0.403865 0.056671 0.396942 0.040 Uiso 1 1 calc R U . . .
C12 C 0.3927(3) 0.3846(4) 0.5968(3) 0.0236(9) Uani 1 1 d . . . . .
H12 H 0.374765 0.472543 0.585864 0.028 Uiso 1 1 calc R U . . .
C19 C 0.3192(3) -0.1683(4) 0.6947(2) 0.0230(9) Uani 1 1 d . . . . .
H19 H 0.368826 -0.107413 0.715914 0.028 Uiso 1 1 calc R U . . .
C23 C 0.2106(4) 0.0417(6) 0.3755(3) 0.0394(12) Uani 1 1 d . . . . .
H23A H 0.198613 0.128808 0.362941 0.059 Uiso 1 1 calc R U . . .
H23B H 0.155192 0.002320 0.379727 0.059 Uiso 1 1 calc R U . . .
H23C H 0.229917 0.001632 0.334772 0.059 Uiso 1 1 calc R U . . .
C13 C 0.4632(3) 0.3570(5) 0.5555(3) 0.0331(11) Uani 1 1 d . . . . .
H13A H 0.483309 0.271596 0.565165 0.050 Uiso 1 1 calc R U . . .
H13B H 0.515274 0.412035 0.574798 0.050 Uiso 1 1 calc R U . . .
H13C H 0.436332 0.369785 0.500113 0.050 Uiso 1 1 calc R U . . .
C21 C 0.3340(4) -0.1321(5) 0.4615(3) 0.0401(13) Uani 1 1 d . . . . .
H21A H 0.357504 -0.142127 0.417430 0.060 Uiso 1 1 calc R U . . .
H21B H 0.281237 -0.185638 0.455118 0.060 Uiso 1 1 calc R U . . .
H21C H 0.381212 -0.154083 0.508896 0.060 Uiso 1 1 calc R U . . .
C8 C 0.1322(3) 0.3186(5) 0.4350(3) 0.0332(11) Uani 1 1 d . . . . .
H8A H 0.123439 0.232754 0.447352 0.050 Uiso 1 1 calc R U . . .
H8B H 0.110359 0.330235 0.379119 0.050 Uiso 1 1 calc R U . . .
H8C H 0.098056 0.372187 0.459688 0.050 Uiso 1 1 calc R U . . .
C15 C 0.0814(3) -0.1333(4) 0.4930(3) 0.0306(10) Uani 1 1 d . . . . .
H15A H 0.033306 -0.111814 0.515752 0.046 Uiso 1 1 calc R U . . .
H15B H 0.057364 -0.190033 0.449974 0.046 Uiso 1 1 calc R U . . .
H15C H 0.103371 -0.058610 0.474263 0.046 Uiso 1 1 calc R U . . .
C10 C 0.2468(4) 0.4871(5) 0.4517(3) 0.0379(12) Uani 1 1 d . . . . .
H10A H 0.219070 0.535837 0.483985 0.057 Uiso 1 1 calc R U . . .
H10B H 0.218024 0.507417 0.397469 0.057 Uiso 1 1 calc R U . . .
H10C H 0.311794 0.505491 0.465371 0.057 Uiso 1 1 calc R U . . .
C18 C 0.2962(4) -0.2175(6) 0.7643(3) 0.0438(14) Uani 1 1 d . . . . .
H18A H 0.271859 -0.150905 0.788603 0.066 Uiso 1 1 calc R U . . .
H18B H 0.351037 -0.250700 0.801156 0.066 Uiso 1 1 calc R U . . .
H18C H 0.250694 -0.282694 0.748325 0.066 Uiso 1 1 calc R U . . .
C24 C 0.3557(3) 0.1474(4) 0.7860(2) 0.0234(9) Uani 1 1 d . . . . .
H24A H 0.368847 0.061314 0.801029 0.035 Uiso 1 1 calc R U . . .
H24B H 0.336830 0.190430 0.826016 0.035 Uiso 1 1 calc R U . . .
H24C H 0.410261 0.186444 0.779800 0.035 Uiso 1 1 calc R U . . .
H H 0.187(4) 0.112(5) 0.555(3) 0.030(13) Uiso 1 1 d . . . . .


_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
Co1 P3 2.2417(10) . ?
Co1 Cl1 2.3233(10) . ?
Co1 P1 2.2286(11) . ?
Co1 Si1 2.2374(11) . ?
Co1 P2 2.2972(11) . ?
Co1 H 1.43(5) . ?
P3 C14 1.871(4) . ?
P3 C16 1.867(4) . ?
P3 C19 1.878(4) . ?
P1 C7 1.878(4) . ?
P1 C9 1.867(4) . ?
P1 C12 1.859(4) . ?
Si1 N1 1.775(3) . ?
Si1 N2 1.767(3) . ?
Si1 C24 1.878(4) . ?
P2 C22 1.829(4) . ?
P2 C23 1.831(5) . ?
P2 C21 1.825(5) . ?
N1 C5 1.401(5) . ?
N1 C14 1.456(5) . ?
N2 C4 1.409(5) . ?
N2 C7 1.457(5) . ?
C5 C6 1.393(5) . ?
C5 C4 1.415(5) . ?
C6 H6 0.9500 . ?
C6 C1 1.401(5) . ?
C4 C3 1.389(5) . ?
C7 H7A 0.9900 . ?
C7 H7B 0.9900 . ?
C14 H14A 0.9900 . ?
C14 H14B 0.9900 . ?
C2 H2 0.9500 . ?
C2 C3 1.399(6) . ?
C2 C1 1.379(6) . ?
C3 H3 0.9500 . ?
C1 H1 0.9500 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C11 C12 1.532(6) . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C20 C19 1.523(6) . ?
C9 H9 1.0000 . ?
C9 C8 1.539(6) . ?
C9 C10 1.523(6) . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
C17 C16 1.545(6) . ?
C16 H16 1.0000 . ?
C16 C15 1.526(6) . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C12 H12 1.0000 . ?
C12 C13 1.525(6) . ?
C19 H19 1.0000 . ?
C19 C18 1.513(6) . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?

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
P3 Co1 Cl1 98.35(4) . . ?
P3 Co1 P2 102.02(4) . . ?
P3 Co1 H 79(2) . . ?
Cl1 Co1 H 176(2) . . ?
P1 Co1 P3 153.21(4) . . ?
P1 Co1 Cl1 100.01(4) . . ?
P1 Co1 Si1 80.83(4) . . ?
P1 Co1 P2 98.41(4) . . ?
P1 Co1 H 82(2) . . ?
Si1 Co1 P3 78.33(4) . . ?
Si1 Co1 Cl1 94.84(4) . . ?
Si1 Co1 P2 178.52(5) . . ?
Si1 Co1 H 82(2) . . ?
P2 Co1 Cl1 86.54(4) . . ?
P2 Co1 H 97(2) . . ?
C14 P3 Co1 110.08(12) . . ?
C14 P3 C19 105.44(19) . . ?
C16 P3 Co1 121.87(14) . . ?
C16 P3 C14 98.72(18) . . ?
C16 P3 C19 106.34(19) . . ?
C19 P3 Co1 112.51(14) . . ?
C7 P1 Co1 111.12(13) . . ?
C9 P1 Co1 117.01(14) . . ?
C9 P1 C7 101.27(19) . . ?
C12 P1 Co1 122.97(14) . . ?
C12 P1 C7 98.5(2) . . ?
C12 P1 C9 102.51(19) . . ?
N1 Si1 Co1 111.50(11) . . ?
N1 Si1 C24 105.64(18) . . ?
N2 Si1 Co1 110.75(11) . . ?
N2 Si1 N1 92.13(15) . . ?
N2 Si1 C24 111.16(18) . . ?
C24 Si1 Co1 121.59(14) . . ?
C22 P2 Co1 115.17(15) . . ?
C22 P2 C23 99.9(2) . . ?
C23 P2 Co1 122.86(18) . . ?
C21 P2 Co1 116.68(17) . . ?
C21 P2 C22 97.7(2) . . ?
C21 P2 C23 100.4(3) . . ?
C5 N1 Si1 110.1(2) . . ?
C5 N1 C14 118.5(3) . . ?
C14 N1 Si1 115.1(2) . . ?
C4 N2 Si1 110.1(2) . . ?
C4 N2 C7 117.8(3) . . ?
C7 N2 Si1 116.9(2) . . ?
N1 C5 C4 113.9(3) . . ?
C6 C5 N1 125.9(3) . . ?
C6 C5 C4 120.1(3) . . ?
C5 C6 H6 120.4 . . ?
C5 C6 C1 119.3(4) . . ?
C1 C6 H6 120.4 . . ?
N2 C4 C5 113.8(3) . . ?
C3 C4 N2 126.1(3) . . ?
C3 C4 C5 120.0(4) . . ?
P1 C7 H7A 109.7 . . ?
P1 C7 H7B 109.7 . . ?
N2 C7 P1 109.6(3) . . ?
N2 C7 H7A 109.7 . . ?
N2 C7 H7B 109.7 . . ?
H7A C7 H7B 108.2 . . ?
P3 C14 H14A 109.8 . . ?
P3 C14 H14B 109.8 . . ?
N1 C14 P3 109.2(3) . . ?
N1 C14 H14A 109.8 . . ?
N1 C14 H14B 109.8 . . ?
H14A C14 H14B 108.3 . . ?
C3 C2 H2 119.5 . . ?
C1 C2 H2 119.5 . . ?
C1 C2 C3 121.1(4) . . ?
C4 C3 C2 119.2(4) . . ?
C4 C3 H3 120.4 . . ?
C2 C3 H3 120.4 . . ?
C6 C1 H1 119.8 . . ?
C2 C1 C6 120.3(4) . . ?
C2 C1 H1 119.8 . . ?
H11A C11 H11B 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C12 C11 H11A 109.5 . . ?
C12 C11 H11B 109.5 . . ?
C12 C11 H11C 109.5 . . ?
H20A C20 H20B 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
P1 C9 H9 106.3 . . ?
C8 C9 P1 111.6(3) . . ?
C8 C9 H9 106.3 . . ?
C10 C9 P1 116.1(3) . . ?
C10 C9 H9 106.3 . . ?
C10 C9 C8 109.7(4) . . ?
H17A C17 H17B 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
P3 C16 H16 107.4 . . ?
C17 C16 P3 113.6(3) . . ?
C17 C16 H16 107.4 . . ?
C15 C16 P3 111.4(3) . . ?
C15 C16 C17 109.3(4) . . ?
C15 C16 H16 107.4 . . ?
P2 C22 H22A 109.5 . . ?
P2 C22 H22B 109.5 . . ?
P2 C22 H22C 109.5 . . ?
H22A C22 H22B 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
P1 C12 H12 106.6 . . ?
C11 C12 P1 110.9(3) . . ?
C11 C12 H12 106.6 . . ?
C13 C12 P1 115.3(3) . . ?
C13 C12 C11 110.3(4) . . ?
C13 C12 H12 106.6 . . ?
P3 C19 H19 104.7 . . ?
C20 C19 P3 112.4(3) . . ?
C20 C19 H19 104.7 . . ?
C18 C19 P3 117.2(3) . . ?
C18 C19 C20 111.8(4) . . ?
C18 C19 H19 104.7 . . ?
P2 C23 H23A 109.5 . . ?
P2 C23 H23B 109.5 . . ?
P2 C23 H23C 109.5 . . ?
H23A C23 H23B 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13B 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
P2 C21 H21A 109.5 . . ?
P2 C21 H21B 109.5 . . ?
P2 C21 H21C 109.5 . . ?
H21A C21 H21B 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C9 C8 H8A 109.5 . . ?
C9 C8 H8B 109.5 . . ?
C9 C8 H8C 109.5 . . ?
H8A C8 H8B 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C16 C15 H15A 109.5 . . ?
C16 C15 H15B 109.5 . . ?
C16 C15 H15C 109.5 . . ?
H15A C15 H15B 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C9 C10 H10A 109.5 . . ?
C9 C10 H10B 109.5 . . ?
C9 C10 H10C 109.5 . . ?
H10A C10 H10B 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C19 C18 H18A 109.5 . . ?
C19 C18 H18B 109.5 . . ?
C19 C18 H18C 109.5 . . ?
H18A C18 H18B 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
Si1 C24 H24A 109.5 . . ?
Si1 C24 H24B 109.5 . . ?
Si1 C24 H24C 109.5 . . ?
H24A C24 H24B 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?

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
Co1 P3 C14 N1 -30.6(3) . . . . ?
Co1 P3 C16 C17 -174.7(2) . . . . ?
Co1 P3 C16 C15 -50.8(3) . . . . ?
Co1 P3 C19 C20 -92.2(3) . . . . ?
Co1 P3 C19 C18 136.4(4) . . . . ?
Co1 P1 C7 N2 21.0(3) . . . . ?
Co1 P1 C9 C8 60.2(3) . . . . ?
Co1 P1 C9 C10 -173.1(3) . . . . ?
Co1 P1 C12 C11 -59.6(4) . . . . ?
Co1 P1 C12 C13 66.6(4) . . . . ?
Co1 Si1 N1 C5 -112.2(2) . . . . ?
Co1 Si1 N1 C14 24.8(3) . . . . ?
Co1 Si1 N2 C4 112.7(2) . . . . ?
Co1 Si1 N2 C7 -25.2(3) . . . . ?
Si1 N1 C5 C6 176.3(3) . . . . ?
Si1 N1 C5 C4 -0.7(4) . . . . ?
Si1 N1 C14 P3 3.6(3) . . . . ?
Si1 N2 C4 C5 1.1(4) . . . . ?
Si1 N2 C4 C3 -176.0(3) . . . . ?
Si1 N2 C7 P1 2.7(4) . . . . ?
N1 Si1 N2 C4 -1.3(3) . . . . ?
N1 Si1 N2 C7 -139.2(3) . . . . ?
N1 C5 C6 C1 -177.3(3) . . . . ?
N1 C5 C4 N2 -0.3(5) . . . . ?
N1 C5 C4 C3 177.0(3) . . . . ?
N2 Si1 N1 C5 1.1(3) . . . . ?
N2 Si1 N1 C14 138.1(3) . . . . ?
N2 C4 C3 C2 176.9(4) . . . . ?
C5 N1 C14 P3 136.9(3) . . . . ?
C5 C6 C1 C2 1.4(6) . . . . ?
C5 C4 C3 C2 -0.1(6) . . . . ?
C6 C5 C4 N2 -177.4(3) . . . . ?
C6 C5 C4 C3 -0.2(6) . . . . ?
C4 N2 C7 P1 -132.0(3) . . . . ?
C4 C5 C6 C1 -0.5(5) . . . . ?
C7 P1 C9 C8 -60.7(4) . . . . ?
C7 P1 C9 C10 66.0(4) . . . . ?
C7 P1 C12 C11 62.5(3) . . . . ?
C7 P1 C12 C13 -171.3(3) . . . . ?
C7 N2 C4 C5 138.6(3) . . . . ?
C7 N2 C4 C3 -38.5(6) . . . . ?
C14 P3 C16 C17 -54.5(3) . . . . ?
C14 P3 C16 C15 69.4(3) . . . . ?
C14 P3 C19 C20 147.8(3) . . . . ?
C14 P3 C19 C18 16.4(4) . . . . ?
C14 N1 C5 C6 40.9(5) . . . . ?
C14 N1 C5 C4 -136.1(3) . . . . ?
C3 C2 C1 C6 -1.7(6) . . . . ?
C1 C2 C3 C4 1.0(6) . . . . ?
C9 P1 C7 N2 145.9(3) . . . . ?
C9 P1 C12 C11 166.1(3) . . . . ?
C9 P1 C12 C13 -67.7(4) . . . . ?
C16 P3 C14 N1 -159.3(3) . . . . ?
C16 P3 C19 C20 43.7(4) . . . . ?
C16 P3 C19 C18 -87.8(4) . . . . ?
C12 P1 C7 N2 -109.4(3) . . . . ?
C12 P1 C9 C8 -162.2(3) . . . . ?
C12 P1 C9 C10 -35.4(4) . . . . ?
C19 P3 C14 N1 91.0(3) . . . . ?
C19 P3 C16 C17 54.6(3) . . . . ?
C19 P3 C16 C15 178.5(3) . . . . ?
C24 Si1 N1 C5 113.8(3) . . . . ?
C24 Si1 N1 C14 -109.2(3) . . . . ?
C24 Si1 N2 C4 -108.9(3) . . . . ?
C24 Si1 N2 C7 113.1(3) . . . . ?

_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details 
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
