# Electronic Supplementary Material (ESI) for Dalton Transactions.
# This journal is © The Royal Society of Chemistry 2014

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#                                CCDC 
# 
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# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
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# 
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#  data retrieval see:
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#  from this site to visualise CIF-encoded structures and 
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data_shelx

_audit_creation_method           SHELXL-2013
_chemical_name_systematic        
;
 ?
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C26 H55 N O5 P2 Ru'
_chemical_formula_sum            'C26 H55 N O5 P2 Ru'
_chemical_formula_weight         624.72

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'
O O 0.0106 0.0060 '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'
Ru Ru -1.2594 0.8363 '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                   11.6024(4)
_cell_length_b                   20.5977(6)
_cell_length_c                   14.1642(4)
_cell_angle_alpha                90
_cell_angle_beta                 113.029(2)
_cell_angle_gamma                90
_cell_volume                     3115.24(17)
_cell_formula_units_Z            4
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    0
_cell_measurement_theta_min      0
_cell_measurement_theta_max      0

_exptl_crystal_description       prism
_exptl_crystal_colour            red
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_density_diffrn    1.332
_exptl_crystal_F_000             1328
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_exptl_absorpt_coefficient_mu    0.639
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.7789
_exptl_absorpt_correction_T_max  0.9481
_exptl_absorpt_process_details   ?

_exptl_special_details           
;
 ?
;

_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'STOE IPDS II T'
_diffrn_measurement_method       'w scans'
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            31157
_diffrn_reflns_av_unetI/netI     0.0227
_diffrn_reflns_av_R_equivalents  0.0394
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_k_max       26
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_theta_min         1.849
_diffrn_reflns_theta_max         26.789
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             6585
_reflns_number_gt                5721
_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 2001)'
_computing_cell_refinement       'X-AREA (STOE & Cie 2001)'
_computing_data_reduction        'X-RED (STOE & Cie 2001)'
_computing_structure_solution    'SIR92 (Burla et al., 1992)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
_computing_publication_material  'WinGX publication routines (Farrugia, 2012)'

_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)+(0.0459P)²+2.3663P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6585
_refine_ls_number_parameters     316
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0376
_refine_ls_R_factor_gt           0.0308
_refine_ls_wR_factor_ref         0.0823
_refine_ls_wR_factor_gt          0.0780
_refine_ls_goodness_of_fit_ref   1.027
_refine_ls_restrained_S_all      1.027
_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
Ru1 Ru 0.27150(2) 0.14775(2) 0.75056(2) 0.02251(7) Uani 1 1 d . . . . .
H1 H 0.2716 0.0778 0.7954 0.027 Uiso 1 1 d R U . . .
P02 P 0.10666(5) 0.16665(3) 0.80379(4) 0.02603(12) Uani 1 1 d . . . . .
P01 P 0.40374(5) 0.08741(3) 0.69363(4) 0.02597(12) Uani 1 1 d . . . . .
O03 O 0.38799(18) 0.30904(9) 0.76510(14) 0.0409(4) Uani 1 1 d . . . . .
O02 O 0.25808(16) 0.23711(8) 0.65935(14) 0.0364(4) Uani 1 1 d . . . . .
O01 O 0.47235(19) 0.19162(12) 0.94661(15) 0.0575(6) Uani 1 1 d . . . . .
N01 N 0.11766(17) 0.10770(9) 0.60997(14) 0.0282(4) Uani 1 1 d . . . . .
C02 C 0.3108(2) 0.29149(12) 0.6786(2) 0.0336(5) Uani 1 1 d . . . . .
C17 C 0.0595(2) 0.25305(12) 0.8155(2) 0.0365(5) Uani 1 1 d . . . . .
C07 C 0.5311(2) 0.12566(13) 0.6601(2) 0.0369(5) Uani 1 1 d . . . . .
C21 C 0.1115(2) 0.11749(14) 0.91935(19) 0.0368(5) Uani 1 1 d . . . . .
C04 C 0.0665(2) 0.15666(14) 0.52687(18) 0.0388(6) Uani 1 1 d . . . . .
H04A H 0.0385 0.1940 0.5525 0.058 Uiso 1 1 calc R U . . .
H04B H -0.0026 0.1382 0.4707 0.058 Uiso 1 1 calc R U . . .
H04C H 0.1307 0.1694 0.5037 0.058 Uiso 1 1 calc R U . . .
C05 C 0.1617(2) 0.05016(13) 0.5687(2) 0.0392(6) Uani 1 1 d . . . . .
H05A H 0.1027 0.0418 0.4992 0.047 Uiso 1 1 calc R U . . .
H05B H 0.1626 0.0124 0.6099 0.047 Uiso 1 1 calc R U . . .
C01 C 0.3947(2) 0.17549(13) 0.8691(2) 0.0367(5) Uani 1 1 d . . . . .
C11 C 0.4689(3) 0.01121(13) 0.7703(2) 0.0398(6) Uani 1 1 d . . . . .
C15 C 0.0133(2) 0.08370(12) 0.63779(19) 0.0323(5) Uani 1 1 d . . . . .
H15A H 0.0408 0.0449 0.6794 0.039 Uiso 1 1 calc R U . . .
H15B H -0.0572 0.0719 0.5755 0.039 Uiso 1 1 calc R U . . .
C16 C -0.0296(2) 0.13321(12) 0.69605(18) 0.0317(5) Uani 1 1 d . . . . .
H16A H -0.0866 0.1129 0.7222 0.038 Uiso 1 1 calc R U . . .
H16B H -0.0741 0.1681 0.6502 0.038 Uiso 1 1 calc R U . . .
C13 C 0.5374(3) 0.02905(18) 0.8833(2) 0.0574(8) Uani 1 1 d . . . . .
H13A H 0.6058 0.0576 0.8909 0.086 Uiso 1 1 calc R U . . .
H13B H 0.5690 -0.0097 0.9227 0.086 Uiso 1 1 calc R U . . .
H13C H 0.4804 0.0504 0.9074 0.086 Uiso 1 1 calc R U . . .
C19 C 0.0273(3) 0.28514(15) 0.7110(2) 0.0542(8) Uani 1 1 d . . . . .
H19A H 0.0967 0.2806 0.6907 0.081 Uiso 1 1 calc R U . . .
H19B H 0.0102 0.3304 0.7156 0.081 Uiso 1 1 calc R U . . .
H19C H -0.0452 0.2646 0.6611 0.081 Uiso 1 1 calc R U . . .
C06 C 0.2916(2) 0.05932(14) 0.5682(2) 0.0396(6) Uani 1 1 d . . . . .
H06A H 0.2874 0.0908 0.5160 0.048 Uiso 1 1 calc R U . . .
H06B H 0.3203 0.0185 0.5511 0.048 Uiso 1 1 calc R U . . .
C22 C 0.1313(4) 0.04661(16) 0.9042(3) 0.0662(10) Uani 1 1 d . . . . .
H22A H 0.2061 0.0415 0.8912 0.099 Uiso 1 1 calc R U . . .
H22B H 0.0609 0.0303 0.8469 0.099 Uiso 1 1 calc R U . . .
H22C H 0.1397 0.0229 0.9649 0.099 Uiso 1 1 calc R U . . .
C12 C 0.5554(3) -0.02819(15) 0.7327(3) 0.0507(7) Uani 1 1 d . . . . .
H12A H 0.6250 -0.0017 0.7360 0.076 Uiso 1 1 calc R U . . .
H12B H 0.5095 -0.0417 0.6632 0.076 Uiso 1 1 calc R U . . .
H12C H 0.5857 -0.0657 0.7756 0.076 Uiso 1 1 calc R U . . .
C08 C 0.4850(4) 0.19218(17) 0.6171(3) 0.0660(10) Uani 1 1 d . . . . .
H08A H 0.4108 0.1879 0.5556 0.099 Uiso 1 1 calc R U . . .
H08B H 0.5487 0.2140 0.6017 0.099 Uiso 1 1 calc R U . . .
H08C H 0.4662 0.2170 0.6667 0.099 Uiso 1 1 calc R U . . .
C03 C 0.2777(3) 0.33821(15) 0.5893(2) 0.0498(7) Uani 1 1 d . . . . .
H03A H 0.3231 0.3780 0.6123 0.075 Uiso 1 1 calc R U . . .
H03B H 0.1894 0.3469 0.5624 0.075 Uiso 1 1 calc R U . . .
H03C H 0.2995 0.3193 0.5366 0.075 Uiso 1 1 calc R U . . .
C09 C 0.5676(3) 0.08826(17) 0.5830(3) 0.0564(8) Uani 1 1 d . . . . .
H09A H 0.5966 0.0458 0.6095 0.085 Uiso 1 1 calc R U . . .
H09B H 0.6331 0.1111 0.5715 0.085 Uiso 1 1 calc R U . . .
H09C H 0.4961 0.0844 0.5194 0.085 Uiso 1 1 calc R U . . .
C14 C 0.3605(3) -0.03454(14) 0.7622(3) 0.0592(9) Uani 1 1 d . . . . .
H14A H 0.3034 -0.0123 0.7851 0.089 Uiso 1 1 calc R U . . .
H14B H 0.3933 -0.0721 0.8044 0.089 Uiso 1 1 calc R U . . .
H14C H 0.3171 -0.0478 0.6922 0.089 Uiso 1 1 calc R U . . .
C10 C 0.6494(3) 0.1354(2) 0.7585(3) 0.0628(9) Uani 1 1 d . . . . .
H10A H 0.6815 0.0939 0.7880 0.094 Uiso 1 1 calc R U . . .
H10B H 0.6289 0.1606 0.8068 0.094 Uiso 1 1 calc R U . . .
H10C H 0.7118 0.1579 0.7421 0.094 Uiso 1 1 calc R U . . .
C20 C 0.1724(3) 0.28834(15) 0.8931(3) 0.0570(8) Uani 1 1 d . . . . .
H20A H 0.2436 0.2821 0.8755 0.086 Uiso 1 1 calc R U . . .
H20B H 0.1906 0.2712 0.9604 0.086 Uiso 1 1 calc R U . . .
H20C H 0.1543 0.3339 0.8922 0.086 Uiso 1 1 calc R U . . .
C18 C -0.0538(4) 0.26220(17) 0.8429(4) 0.0785(13) Uani 1 1 d . . . . .
H18A H -0.1245 0.2400 0.7936 0.118 Uiso 1 1 calc R U . . .
H18B H -0.0725 0.3076 0.8423 0.118 Uiso 1 1 calc R U . . .
H18C H -0.0360 0.2448 0.9100 0.118 Uiso 1 1 calc R U . . .
C24 C -0.0066(5) 0.1211(3) 0.9394(4) 0.133(3) Uani 1 1 d . . . . .
H24A H -0.0237 0.1655 0.9498 0.199 Uiso 1 1 calc R U . . .
H24B H 0.0038 0.0963 0.9996 0.199 Uiso 1 1 calc R U . . .
H24C H -0.0753 0.1038 0.8816 0.199 Uiso 1 1 calc R U . . .
C23 C 0.2220(5) 0.1391(2) 1.0138(3) 0.0977(18) Uani 1 1 d . . . . .
H23A H 0.2971 0.1365 1.0009 0.147 Uiso 1 1 calc R U . . .
H23B H 0.2295 0.1115 1.0705 0.147 Uiso 1 1 calc R U . . .
H23C H 0.2094 0.1832 1.0299 0.147 Uiso 1 1 calc R U . . .
O201 O -0.01924(17) 0.07958(9) 0.28585(15) 0.0392(4) Uani 1 1 d . . . . .
H201 H -0.0432 0.1174 0.2777 0.059 Uiso 1 1 calc R U . . .
O200 O 0.1496(2) 0.02528(10) 0.3002(2) 0.0564(6) Uani 1 1 d . . . . .
C101 C 0.0948(2) 0.07641(13) 0.2880(2) 0.0374(5) Uani 1 1 d . . . . .
C100 C 0.1527(3) 0.13916(15) 0.2756(3) 0.0533(7) Uani 1 1 d . . . . .
H10D H 0.0943 0.1739 0.2669 0.080 Uiso 1 1 calc R U . . .
H10E H 0.1736 0.1367 0.2165 0.080 Uiso 1 1 calc R U . . .
H10F H 0.2272 0.1471 0.3356 0.080 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
Ru1 C01 1.820(3) . ?
Ru1 O02 2.2191(17) . ?
Ru1 N01 2.2474(18) . ?
Ru1 P02 2.3464(6) . ?
Ru1 P01 2.3488(6) . ?
Ru1 H1 1.5747 . ?
P02 C16 1.848(2) . ?
P02 C17 1.888(3) . ?
P02 C21 1.907(3) . ?
P01 C06 1.838(3) . ?
P01 C11 1.890(3) . ?
P01 C07 1.891(2) . ?
O03 C02 1.255(3) . ?
O02 C02 1.254(3) . ?
O01 C01 1.163(3) . ?
N01 C04 1.486(3) . ?
N01 C15 1.496(3) . ?
N01 C05 1.497(3) . ?
C02 C03 1.514(4) . ?
C17 C18 1.520(4) . ?
C17 C20 1.526(4) . ?
C17 C19 1.528(4) . ?
C07 C08 1.510(4) . ?
C07 C09 1.526(4) . ?
C07 C10 1.540(4) . ?
C21 C24 1.506(4) . ?
C21 C22 1.506(4) . ?
C21 C23 1.513(4) . ?
C04 H04A 0.9600 . ?
C04 H04B 0.9600 . ?
C04 H04C 0.9600 . ?
C05 C06 1.522(4) . ?
C05 H05A 0.9700 . ?
C05 H05B 0.9700 . ?
C11 C13 1.528(4) . ?
C11 C12 1.539(3) . ?
C11 C14 1.540(4) . ?
C15 C16 1.513(3) . ?
C15 H15A 0.9700 . ?
C15 H15B 0.9700 . ?
C16 H16A 0.9700 . ?
C16 H16B 0.9700 . ?
C13 H13A 0.9600 . ?
C13 H13B 0.9600 . ?
C13 H13C 0.9600 . ?
C19 H19A 0.9600 . ?
C19 H19B 0.9600 . ?
C19 H19C 0.9600 . ?
C06 H06A 0.9700 . ?
C06 H06B 0.9700 . ?
C22 H22A 0.9600 . ?
C22 H22B 0.9600 . ?
C22 H22C 0.9600 . ?
C12 H12A 0.9600 . ?
C12 H12B 0.9600 . ?
C12 H12C 0.9600 . ?
C08 H08A 0.9600 . ?
C08 H08B 0.9600 . ?
C08 H08C 0.9600 . ?
C03 H03A 0.9600 . ?
C03 H03B 0.9600 . ?
C03 H03C 0.9600 . ?
C09 H09A 0.9600 . ?
C09 H09B 0.9600 . ?
C09 H09C 0.9600 . ?
C14 H14A 0.9600 . ?
C14 H14B 0.9600 . ?
C14 H14C 0.9600 . ?
C10 H10A 0.9600 . ?
C10 H10B 0.9600 . ?
C10 H10C 0.9600 . ?
C20 H20A 0.9600 . ?
C20 H20B 0.9600 . ?
C20 H20C 0.9600 . ?
C18 H18A 0.9600 . ?
C18 H18B 0.9600 . ?
C18 H18C 0.9600 . ?
C24 H24A 0.9600 . ?
C24 H24B 0.9600 . ?
C24 H24C 0.9600 . ?
C23 H23A 0.9600 . ?
C23 H23B 0.9600 . ?
C23 H23C 0.9600 . ?
O201 C101 1.314(3) . ?
O201 H201 0.8200 . ?
O200 C101 1.207(3) . ?
C101 C100 1.498(4) . ?
C100 H10D 0.9600 . ?
C100 H10E 0.9600 . ?
C100 H10F 0.9600 . ?

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
C01 Ru1 O02 97.34(10) . . ?
C01 Ru1 N01 176.16(10) . . ?
O02 Ru1 N01 86.45(7) . . ?
C01 Ru1 P02 95.52(8) . . ?
O02 Ru1 P02 99.73(5) . . ?
N01 Ru1 P02 83.16(5) . . ?
C01 Ru1 P01 95.75(8) . . ?
O02 Ru1 P01 98.37(5) . . ?
N01 Ru1 P01 84.30(5) . . ?
P02 Ru1 P01 157.24(2) . . ?
C01 Ru1 H1 92.2 . . ?
O02 Ru1 H1 169.3 . . ?
N01 Ru1 H1 84.1 . . ?
P02 Ru1 H1 83.9 . . ?
P01 Ru1 H1 75.9 . . ?
C16 P02 C17 103.88(11) . . ?
C16 P02 C21 103.83(12) . . ?
C17 P02 C21 109.71(12) . . ?
C16 P02 Ru1 102.39(8) . . ?
C17 P02 Ru1 119.04(8) . . ?
C21 P02 Ru1 115.71(8) . . ?
C06 P01 C11 105.49(14) . . ?
C06 P01 C07 102.46(12) . . ?
C11 P01 C07 108.31(12) . . ?
C06 P01 Ru1 100.83(8) . . ?
C11 P01 Ru1 114.21(8) . . ?
C07 P01 Ru1 123.02(9) . . ?
C02 O02 Ru1 134.21(16) . . ?
C04 N01 C15 108.62(19) . . ?
C04 N01 C05 108.6(2) . . ?
C15 N01 C05 106.03(18) . . ?
C04 N01 Ru1 112.67(14) . . ?
C15 N01 Ru1 109.39(13) . . ?
C05 N01 Ru1 111.26(14) . . ?
O02 C02 O03 124.8(2) . . ?
O02 C02 C03 116.3(2) . . ?
O03 C02 C03 118.9(2) . . ?
C18 C17 C20 110.0(3) . . ?
C18 C17 C19 106.6(3) . . ?
C20 C17 C19 107.9(3) . . ?
C18 C17 P02 116.7(2) . . ?
C20 C17 P02 108.37(19) . . ?
C19 C17 P02 106.99(18) . . ?
C08 C07 C09 108.8(3) . . ?
C08 C07 C10 107.2(3) . . ?
C09 C07 C10 108.4(2) . . ?
C08 C07 P01 106.94(18) . . ?
C09 C07 P01 115.6(2) . . ?
C10 C07 P01 109.57(19) . . ?
C24 C21 C22 106.0(4) . . ?
C24 C21 C23 109.7(4) . . ?
C22 C21 C23 106.7(3) . . ?
C24 C21 P02 114.4(2) . . ?
C22 C21 P02 110.32(18) . . ?
C23 C21 P02 109.4(2) . . ?
N01 C04 H04A 109.5 . . ?
N01 C04 H04B 109.5 . . ?
H04A C04 H04B 109.5 . . ?
N01 C04 H04C 109.5 . . ?
H04A C04 H04C 109.5 . . ?
H04B C04 H04C 109.5 . . ?
N01 C05 C06 113.2(2) . . ?
N01 C05 H05A 108.9 . . ?
C06 C05 H05A 108.9 . . ?
N01 C05 H05B 108.9 . . ?
C06 C05 H05B 108.9 . . ?
H05A C05 H05B 107.8 . . ?
O01 C01 Ru1 177.8(3) . . ?
C13 C11 C12 110.3(2) . . ?
C13 C11 C14 107.5(3) . . ?
C12 C11 C14 106.0(2) . . ?
C13 C11 P01 109.2(2) . . ?
C12 C11 P01 114.04(18) . . ?
C14 C11 P01 109.5(2) . . ?
N01 C15 C16 113.19(19) . . ?
N01 C15 H15A 108.9 . . ?
C16 C15 H15A 108.9 . . ?
N01 C15 H15B 108.9 . . ?
C16 C15 H15B 108.9 . . ?
H15A C15 H15B 107.8 . . ?
C15 C16 P02 110.09(16) . . ?
C15 C16 H16A 109.6 . . ?
P02 C16 H16A 109.6 . . ?
C15 C16 H16B 109.6 . . ?
P02 C16 H16B 109.6 . . ?
H16A C16 H16B 108.2 . . ?
C11 C13 H13A 109.5 . . ?
C11 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
C11 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C17 C19 H19A 109.5 . . ?
C17 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C17 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C05 C06 P01 111.26(17) . . ?
C05 C06 H06A 109.4 . . ?
P01 C06 H06A 109.4 . . ?
C05 C06 H06B 109.4 . . ?
P01 C06 H06B 109.4 . . ?
H06A C06 H06B 108.0 . . ?
C21 C22 H22A 109.5 . . ?
C21 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C21 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
C11 C12 H12A 109.5 . . ?
C11 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C11 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C07 C08 H08A 109.5 . . ?
C07 C08 H08B 109.5 . . ?
H08A C08 H08B 109.5 . . ?
C07 C08 H08C 109.5 . . ?
H08A C08 H08C 109.5 . . ?
H08B C08 H08C 109.5 . . ?
C02 C03 H03A 109.5 . . ?
C02 C03 H03B 109.5 . . ?
H03A C03 H03B 109.5 . . ?
C02 C03 H03C 109.5 . . ?
H03A C03 H03C 109.5 . . ?
H03B C03 H03C 109.5 . . ?
C07 C09 H09A 109.5 . . ?
C07 C09 H09B 109.5 . . ?
H09A C09 H09B 109.5 . . ?
C07 C09 H09C 109.5 . . ?
H09A C09 H09C 109.5 . . ?
H09B C09 H09C 109.5 . . ?
C11 C14 H14A 109.5 . . ?
C11 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C11 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C07 C10 H10A 109.5 . . ?
C07 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C07 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C17 C20 H20A 109.5 . . ?
C17 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C17 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C17 C18 H18A 109.5 . . ?
C17 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C17 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C21 C24 H24A 109.5 . . ?
C21 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C21 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C21 C23 H23A 109.5 . . ?
C21 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C21 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C101 O201 H201 109.5 . . ?
O200 C101 O201 121.1(2) . . ?
O200 C101 C100 122.3(3) . . ?
O201 C101 C100 116.6(2) . . ?
C101 C100 H10D 109.5 . . ?
C101 C100 H10E 109.5 . . ?
H10D C100 H10E 109.5 . . ?
C101 C100 H10F 109.5 . . ?
H10D C100 H10F 109.5 . . ?
H10E C100 H10F 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
Ru1 O02 C02 O03 -3.0(4) . . . . ?
Ru1 O02 C02 C03 176.58(19) . . . . ?
C16 P02 C17 C18 62.8(3) . . . . ?
C21 P02 C17 C18 -47.7(3) . . . . ?
Ru1 P02 C17 C18 175.8(2) . . . . ?
C16 P02 C17 C20 -172.4(2) . . . . ?
C21 P02 C17 C20 77.1(2) . . . . ?
Ru1 P02 C17 C20 -59.5(2) . . . . ?
C16 P02 C17 C19 -56.4(2) . . . . ?
C21 P02 C17 C19 -166.9(2) . . . . ?
Ru1 P02 C17 C19 56.6(2) . . . . ?
C06 P01 C07 C08 79.4(2) . . . . ?
C11 P01 C07 C08 -169.5(2) . . . . ?
Ru1 P01 C07 C08 -32.6(3) . . . . ?
C06 P01 C07 C09 -42.0(3) . . . . ?
C11 P01 C07 C09 69.2(3) . . . . ?
Ru1 P01 C07 C09 -153.89(19) . . . . ?
C06 P01 C07 C10 -164.7(2) . . . . ?
C11 P01 C07 C10 -53.6(2) . . . . ?
Ru1 P01 C07 C10 83.3(2) . . . . ?
C04 N01 C05 C06 81.8(3) . . . . ?
C15 N01 C05 C06 -161.6(2) . . . . ?
Ru1 N01 C05 C06 -42.8(3) . . . . ?
C06 P01 C11 C13 -165.9(2) . . . . ?
C07 P01 C11 C13 85.0(2) . . . . ?
Ru1 P01 C11 C13 -56.1(2) . . . . ?
C06 P01 C11 C12 70.2(2) . . . . ?
C07 P01 C11 C12 -38.9(3) . . . . ?
Ru1 P01 C11 C12 179.97(19) . . . . ?
C06 P01 C11 C14 -48.4(2) . . . . ?
C07 P01 C11 C14 -157.5(2) . . . . ?
Ru1 P01 C11 C14 61.4(2) . . . . ?
C04 N01 C15 C16 -72.2(2) . . . . ?
C05 N01 C15 C16 171.2(2) . . . . ?
Ru1 N01 C15 C16 51.1(2) . . . . ?
N01 C15 C16 P02 -49.5(2) . . . . ?
C17 P02 C16 C15 147.51(18) . . . . ?
C21 P02 C16 C15 -97.74(18) . . . . ?
Ru1 P02 C16 C15 23.02(18) . . . . ?
N01 C05 C06 P01 50.2(3) . . . . ?
C11 P01 C06 C05 88.2(2) . . . . ?
C07 P01 C06 C05 -158.5(2) . . . . ?
Ru1 P01 C06 C05 -30.9(2) . . . . ?

_refine_diff_density_max         0.701
_refine_diff_density_min         -0.620
_refine_diff_density_rms         0.068

_shelxl_version_number           2013-4

_database_code_depnum_ccdc_archive 'CCDC 1002031'
