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#$Date: 2019-11-25 21:25:43 +0200 (Mon, 25 Nov 2019) $
#$Revision: 241852 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/13/16/4131679.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4131679
loop_
_publ_author_name
'Bailey, Gwendolyn A.'
'Lummiss, Justin A. M.'
'Foscato, Marco'
'Occhipinti, Giovanni'
'McDonald, Robert'
'Jensen, Vidar R.'
'Fogg, Deryn E.'
_publ_section_title
;
 Decomposition of Olefin Metathesis Catalysts by Brønsted Base:
 Metallacyclobutane Deprotonation as a Primary Deactivating Event.
;
_journal_issue                   46
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              16446
_journal_page_last               16449
_journal_paper_doi               10.1021/jacs.7b08578
_journal_volume                  139
_journal_year                    2017
_chemical_formula_moiety         'C50 H62 Cl2 N4 O4 Ru2, C6 H6'
_chemical_formula_sum            'C56 H68 Cl2 N4 O4 Ru2'
_chemical_formula_weight         1134.18
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                98.4882(7)
_cell_angle_beta                 109.7667(6)
_cell_angle_gamma                110.9004(6)
_cell_formula_units_Z            1
_cell_length_a                   10.6206(3)
_cell_length_b                   11.5671(3)
_cell_length_c                   13.1397(3)
_cell_measurement_reflns_used    9128
_cell_measurement_temperature    223(2)
_cell_measurement_theta_max      73.69
_cell_measurement_theta_min      6.52
_cell_volume                     1351.46(6)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker APEX2'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXT-2014 (Sheldrick, 2015)'
_diffrn_ambient_temperature      223(2)
_diffrn_measured_fraction_theta_full 0.966
_diffrn_measured_fraction_theta_max 0.957
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0199
_diffrn_reflns_av_unetI/netI     0.0240
_diffrn_reflns_Laue_measured_fraction_full 0.966
_diffrn_reflns_Laue_measured_fraction_max 0.957
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            9618
_diffrn_reflns_point_group_measured_fraction_full 0.966
_diffrn_reflns_point_group_measured_fraction_max 0.957
_diffrn_reflns_theta_full        67.679
_diffrn_reflns_theta_max         73.896
_diffrn_reflns_theta_min         4.296
_exptl_absorpt_coefficient_mu    5.806
_exptl_absorpt_correction_T_max  0.5540
_exptl_absorpt_correction_T_min  0.1924
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   'SADABS 2014/5'
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.394
_exptl_crystal_description       fragment
_exptl_crystal_F_000             586
_exptl_crystal_size_max          0.461
_exptl_crystal_size_mid          0.412
_exptl_crystal_size_min          0.242
_refine_diff_density_max         0.377
_refine_diff_density_min         -1.274
_refine_diff_density_rms         0.075
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.068
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     313
_refine_ls_number_reflns         5255
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.068
_refine_ls_R_factor_all          0.0252
_refine_ls_R_factor_gt           0.0250
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0413P)²+0.5115P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0667
_refine_ls_wR_factor_ref         0.0670
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5185
_reflns_number_total             5255
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ja7b08578_si_002.cif
_cod_data_source_block           ott1506
_cod_database_code               4131679
_shelx_shelxl_version_number     2014/7
_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. 
;
_shelx_estimated_absorpt_t_min   0.175
_shelx_estimated_absorpt_t_max   0.334
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'
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
Ru Ru -0.00692(2) 0.15793(2) 0.03417(2) 0.02774(6) Uani 1 1 d . .
Cl Cl 0.15427(5) 0.05770(4) 0.12008(4) 0.03521(10) Uani 1 1 d . .
O1 O -0.37727(16) 0.17691(16) -0.10662(13) 0.0436(3) Uani 1 1 d . .
O2 O -0.41221(14) -0.01578(14) -0.07667(12) 0.0378(3) Uani 1 1 d . .
N1 N 0.23672(19) 0.39351(18) 0.10722(18) 0.0448(4) Uani 1 1 d . .
N2 N 0.1399(2) 0.41967(17) 0.22701(16) 0.0428(4) Uani 1 1 d . .
C1 C -0.0481(2) 0.2614(2) -0.08079(18) 0.0379(4) Uani 1 1 d . .
H1A H -0.1408 0.2123 -0.1499 0.045 Uiso 1 1 calc R U
H1B H -0.0376 0.3476 -0.0470 0.045 Uiso 1 1 calc R U
C2 C 0.0851(2) 0.2613(2) -0.0922(2) 0.0405(5) Uani 1 1 d . .
C3 C 0.0746(3) 0.1896(2) -0.1935(2) 0.0495(5) Uani 1 1 d . .
H3 H -0.0190 0.1431 -0.2556 0.059 Uiso 1 1 calc R U
C4 C 0.1981(3) 0.1858(3) -0.2041(3) 0.0576(7) Uani 1 1 d . .
C5 C 0.1857(5) 0.1091(4) -0.3133(3) 0.0801(10) Uani 1 1 d . .
H5A H 0.2052 0.0352 -0.3020 0.096 Uiso 1 1 calc R U
H5B H 0.2576 0.1641 -0.3360 0.096 Uiso 1 1 calc R U
H5C H 0.0862 0.0788 -0.3722 0.096 Uiso 1 1 calc R U
C6 C 0.3351(3) 0.2509(3) -0.1095(3) 0.0620(8) Uani 1 1 d . .
H6 H 0.4196 0.2489 -0.1163 0.074 Uiso 1 1 calc R U
C7 C 0.3517(3) 0.3184(2) -0.0059(3) 0.0561(7) Uani 1 1 d . .
C8 C 0.4979(3) 0.3760(3) 0.0963(4) 0.0768(10) Uani 1 1 d . .
H8A H 0.5638 0.3434 0.0804 0.092 Uiso 1 1 calc R U
H8B H 0.4822 0.3521 0.1602 0.092 Uiso 1 1 calc R U
H8C H 0.5423 0.4699 0.1144 0.092 Uiso 1 1 calc R U
C9 C 0.2253(2) 0.3259(2) 0.0020(2) 0.0436(5) Uani 1 1 d . .
C10 C 0.1266(2) 0.3316(2) 0.13878(18) 0.0359(4) Uani 1 1 d . .
C11 C 0.3129(3) 0.5346(2) 0.1627(3) 0.0622(7) Uani 1 1 d . .
H11A H 0.2763 0.5809 0.1120 0.075 Uiso 1 1 calc R U
H11B H 0.4208 0.5680 0.1885 0.075 Uiso 1 1 calc R U
C12 C 0.2711(3) 0.5454(2) 0.2614(3) 0.0625(7) Uani 1 1 d . .
H12A H 0.3523 0.5568 0.3318 0.075 Uiso 1 1 calc R U
H12B H 0.2455 0.6184 0.2722 0.075 Uiso 1 1 calc R U
C13 C 0.0668(2) 0.3889(2) 0.29970(17) 0.0407(4) Uani 1 1 d . .
C14 C -0.0467(2) 0.4251(2) 0.29322(17) 0.0404(4) Uani 1 1 d . .
C15 C -0.0860(3) 0.5044(2) 0.2175(2) 0.0488(5) Uani 1 1 d . .
H15A H 0.0014 0.5848 0.2376 0.059 Uiso 1 1 calc R U
H15B H -0.1635 0.5241 0.2272 0.059 Uiso 1 1 calc R U
H15C H -0.1213 0.4555 0.1390 0.059 Uiso 1 1 calc R U
C16 C -0.1244(3) 0.3870(2) 0.3579(2) 0.0551(6) Uani 1 1 d . .
H16 H -0.2013 0.4112 0.3534 0.066 Uiso 1 1 calc R U
C17 C -0.0920(4) 0.3143(3) 0.4290(2) 0.0678(9) Uani 1 1 d . .
C18 C -0.1837(5) 0.2675(4) 0.4933(3) 0.1090(17) Uani 1 1 d . .
H18A H -0.2724 0.1884 0.4442 0.131 Uiso 1 1 calc R U
H18B H -0.2120 0.3338 0.5182 0.131 Uiso 1 1 calc R U
H18C H -0.1257 0.2503 0.5589 0.131 Uiso 1 1 calc R U
C19 C 0.0265(5) 0.2868(3) 0.4388(2) 0.0744(10) Uani 1 1 d . .
H19 H 0.0531 0.2418 0.4900 0.089 Uiso 1 1 calc R U
C20 C 0.1096(3) 0.3227(2) 0.3761(2) 0.0592(7) Uani 1 1 d . .
C21 C 0.2363(5) 0.2885(4) 0.3869(3) 0.0917(13) Uani 1 1 d . .
H21A H 0.2665 0.2641 0.4556 0.110 Uiso 1 1 calc R U
H21B H 0.3194 0.3629 0.3905 0.110 Uiso 1 1 calc R U
H21C H 0.2047 0.2162 0.3216 0.110 Uiso 1 1 calc R U
C22 C -0.1427(2) 0.0902(2) 0.11587(16) 0.0339(4) Uani 1 1 d . .
H22A H -0.2079 -0.0033 0.0883 0.041 Uiso 1 1 calc R U
H22B H -0.0973 0.1265 0.1988 0.041 Uiso 1 1 calc R U
C23 C -0.19325(19) 0.16723(18) 0.05248(15) 0.0301(3) Uani 1 1 d . .
H23 H -0.1705 0.2528 0.1006 0.036 Uiso 1 1 calc R U
C24 C -0.33396(19) 0.11221(19) -0.05139(15) 0.0313(4) Uani 1 1 d . .
C25 C -0.5475(2) -0.0775(3) -0.17848(19) 0.0513(5) Uani 1 1 d . .
H25A H -0.6080 -0.1627 -0.1775 0.062 Uiso 1 1 calc R U
H25B H -0.5245 -0.0867 -0.2438 0.062 Uiso 1 1 calc R U
H25C H -0.6017 -0.0250 -0.1831 0.062 Uiso 1 1 calc R U
C1S C 0.4546(4) -0.0747(3) 0.3914(2) 0.0651(7) Uani 1 1 d . .
H1S H 0.4237 -0.1261 0.3173 0.078 Uiso 1 1 calc R U
C2S C 0.4019(3) 0.0141(3) 0.4092(2) 0.0655(8) Uani 1 1 d . .
H2S H 0.3347 0.0244 0.3471 0.079 Uiso 1 1 calc R U
C3S C 0.4468(4) 0.0889(3) 0.5176(3) 0.0688(8) Uani 1 1 d . .
H3S H 0.4100 0.1500 0.5295 0.083 Uiso 1 1 calc R U
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'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 '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'
Ru Ru 0.0552 3.2960 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
C10 Ru C22 100.22(8) . .
C10 Ru C1 82.24(8) . .
C22 Ru C1 123.11(7) . .
C10 Ru C23 92.59(8) . .
C22 Ru C23 39.76(7) . .
C1 Ru C23 83.50(7) . .
C10 Ru C2 80.42(8) . .
C22 Ru C2 159.90(7) . .
C1 Ru C2 36.83(7) . .
C23 Ru C2 120.30(7) . .
C10 Ru Cl 95.11(5) . .
C22 Ru Cl 92.51(5) . .
C1 Ru Cl 144.27(5) . .
C23 Ru Cl 132.22(5) . .
C2 Ru Cl 107.49(5) . .
C10 Ru Cl 170.38(6) . 2
C22 Ru Cl 89.40(6) . 2
C1 Ru Cl 92.81(6) . 2
C23 Ru Cl 95.05(5) . 2
C2 Ru Cl 90.66(6) . 2
Cl Ru Cl 84.069(15) . 2
Ru Cl Ru 95.931(15) . 2
C24 O2 C25 116.75(17) . .
C10 N1 C9 116.02(18) . .
C10 N1 C11 112.7(2) . .
C9 N1 C11 126.93(19) . .
C10 N2 C13 124.92(17) . .
C10 N2 C12 111.6(2) . .
C13 N2 C12 121.3(2) . .
C2 C1 Ru 84.90(11) . .
C3 C2 C9 118.47(19) . .
C3 C2 C1 121.2(2) . .
C9 C2 C1 120.1(2) . .
C3 C2 Ru 122.63(15) . .
C9 C2 Ru 86.55(12) . .
C1 C2 Ru 58.27(9) . .
C4 C3 C2 121.7(3) . .
C3 C4 C6 118.3(3) . .
C3 C4 C5 121.3(3) . .
C6 C4 C5 120.4(2) . .
C7 C6 C4 122.7(2) . .
C6 C7 C9 118.1(3) . .
C6 C7 C8 120.8(2) . .
C9 C7 C8 121.0(3) . .
C2 C9 C7 120.5(2) . .
C2 C9 N1 119.29(17) . .
C7 C9 N1 120.1(2) . .
N2 C10 N1 107.09(18) . .
N2 C10 Ru 141.18(15) . .
N1 C10 Ru 111.20(16) . .
N1 C11 C12 101.46(19) . .
N2 C12 C11 103.2(2) . .
C14 C13 C20 120.8(2) . .
C14 C13 N2 119.23(18) . .
C20 C13 N2 119.9(2) . .
C16 C14 C13 119.0(2) . .
C16 C14 C15 119.8(2) . .
C13 C14 C15 121.2(2) . .
C17 C16 C14 121.9(3) . .
C19 C17 C16 117.7(3) . .
C19 C17 C18 121.5(3) . .
C16 C17 C18 120.9(4) . .
C17 C19 C20 123.1(2) . .
C19 C20 C13 117.2(3) . .
C19 C20 C21 121.8(3) . .
C13 C20 C21 121.0(3) . .
C23 C22 Ru 71.16(10) . .
C22 C23 C24 123.28(17) . .
C22 C23 Ru 69.08(10) . .
C24 C23 Ru 117.09(12) . .
O1 C24 O2 122.95(17) . .
O1 C24 C23 123.78(18) . .
O2 C24 C23 113.23(16) . .
C2S C1S C3S 119.6(3) . 2_656
C1S C2S C3S 120.1(3) . .
C1S C3S C2S 120.3(3) 2_656 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ru C10 1.941(2) .
Ru C22 2.0825(18) .
Ru C1 2.0896(18) .
Ru C23 2.1100(17) .
Ru C2 2.4471(18) .
Ru Cl 2.4586(4) .
Ru Cl 2.5210(5) 2
Cl Ru 2.5209(5) 2
O1 C24 1.216(2) .
O2 C24 1.335(2) .
O2 C25 1.432(2) .
N1 C10 1.368(3) .
N1 C9 1.428(3) .
N1 C11 1.469(3) .
N2 C10 1.357(3) .
N2 C13 1.431(3) .
N2 C12 1.482(3) .
C1 C2 1.473(3) .
C2 C3 1.407(3) .
C2 C9 1.412(3) .
C3 C4 1.380(3) .
C4 C6 1.396(5) .
C4 C5 1.509(4) .
C6 C7 1.385(5) .
C7 C9 1.412(3) .
C7 C8 1.498(4) .
C11 C12 1.510(4) .
C13 C14 1.391(3) .
C13 C20 1.403(3) .
C14 C16 1.387(3) .
C14 C15 1.506(3) .
C16 C17 1.386(4) .
C17 C19 1.375(5) .
C17 C18 1.507(4) .
C19 C20 1.400(5) .
C20 C21 1.502(5) .
C22 C23 1.426(3) .
C23 C24 1.479(2) .
C1S C2S 1.361(5) .
C1S C3S 1.373(4) 2_656
C2S C3S 1.374(5) .
C3S C1S 1.373(4) 2_656
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_4
C10 Ru Cl Ru -170.37(6) . 2
C22 Ru Cl Ru 89.13(6) . 2
C1 Ru Cl Ru -86.56(11) . 2
C23 Ru Cl Ru 91.45(7) . 2
C2 Ru Cl Ru -88.82(6) . 2
Cl Ru Cl Ru 0.000(0) 2 2
C10 Ru C1 C2 84.36(14) . .
C22 Ru C1 C2 -178.46(13) . .
C23 Ru C1 C2 177.88(14) . .
Cl Ru C1 C2 -3.6(2) . .
Cl Ru C1 C2 -87.35(13) 2 .
Ru C1 C2 C3 111.50(17) . .
Ru C1 C2 C9 -63.84(17) . .
C10 Ru C2 C3 161.03(19) . .
C22 Ru C2 C3 -105.4(3) . .
C1 Ru C2 C3 -109.1(2) . .
C23 Ru C2 C3 -111.58(18) . .
Cl Ru C2 C3 68.65(18) . .
Cl Ru C2 C3 -15.34(18) 2 .
C10 Ru C2 C9 39.13(13) . .
C22 Ru C2 C9 132.7(2) . .
C1 Ru C2 C9 129.0(2) . .
C23 Ru C2 C9 126.52(12) . .
Cl Ru C2 C9 -53.25(13) . .
Cl Ru C2 C9 -137.24(12) 2 .
C10 Ru C2 C1 -89.83(14) . .
C22 Ru C2 C1 3.7(3) . .
C23 Ru C2 C1 -2.44(16) . .
Cl Ru C2 C1 177.79(12) . .
Cl Ru C2 C1 93.80(13) 2 .
C9 C2 C3 C4 -2.7(3) . .
C1 C2 C3 C4 -178.15(18) . .
Ru C2 C3 C4 -108.2(2) . .
C2 C3 C4 C6 2.7(3) . .
C2 C3 C4 C5 -179.7(2) . .
C3 C4 C6 C7 0.3(3) . .
C5 C4 C6 C7 -177.4(2) . .
C4 C6 C7 C9 -2.9(3) . .
C4 C6 C7 C8 174.1(2) . .
C3 C2 C9 C7 -0.1(3) . .
C1 C2 C9 C7 175.41(18) . .
Ru C2 C9 C7 125.52(17) . .
C3 C2 C9 N1 -176.79(17) . .
C1 C2 C9 N1 -1.3(3) . .
Ru C2 C9 N1 -51.21(17) . .
C6 C7 C9 C2 2.8(3) . .
C8 C7 C9 C2 -174.2(2) . .
C6 C7 C9 N1 179.50(19) . .
C8 C7 C9 N1 2.5(3) . .
C10 N1 C9 C2 42.2(2) . .
C11 N1 C9 C2 -112.4(2) . .
C10 N1 C9 C7 -134.51(19) . .
C11 N1 C9 C7 70.9(3) . .
C13 N2 C10 N1 -166.72(18) . .
C12 N2 C10 N1 -3.6(2) . .
C13 N2 C10 Ru 23.0(3) . .
C12 N2 C10 Ru -173.81(19) . .
C9 N1 C10 N2 -168.22(17) . .
C11 N1 C10 N2 -10.0(2) . .
C9 N1 C10 Ru 5.2(2) . .
C11 N1 C10 Ru 163.43(17) . .
C22 Ru C10 N2 -15.0(2) . .
C1 Ru C10 N2 107.4(2) . .
C23 Ru C10 N2 24.3(2) . .
C2 Ru C10 N2 144.6(2) . .
Cl Ru C10 N2 -108.5(2) . .
C22 Ru C10 N1 175.01(13) . .
C1 Ru C10 N1 -62.61(14) . .
C23 Ru C10 N1 -145.68(14) . .
C2 Ru C10 N1 -25.39(13) . .
Cl Ru C10 N1 81.52(13) . .
C10 N1 C11 C12 18.6(3) . .
C9 N1 C11 C12 173.9(2) . .
C10 N2 C12 C11 14.8(3) . .
C13 N2 C12 C11 178.6(2) . .
N1 C11 C12 N2 -18.7(3) . .
C10 N2 C13 C14 -110.1(2) . .
C12 N2 C13 C14 88.2(3) . .
C10 N2 C13 C20 69.7(3) . .
C12 N2 C13 C20 -91.9(3) . .
C20 C13 C14 C16 -4.4(3) . .
N2 C13 C14 C16 175.44(19) . .
C20 C13 C14 C15 175.6(2) . .
N2 C13 C14 C15 -4.6(3) . .
C13 C14 C16 C17 0.2(3) . .
C15 C14 C16 C17 -179.8(2) . .
C14 C16 C17 C19 3.7(4) . .
C14 C16 C17 C18 -176.5(2) . .
C16 C17 C19 C20 -3.5(4) . .
C18 C17 C19 C20 176.6(3) . .
C17 C19 C20 C13 -0.5(4) . .
C17 C19 C20 C21 -178.6(3) . .
C14 C13 C20 C19 4.6(3) . .
N2 C13 C20 C19 -175.3(2) . .
C14 C13 C20 C21 -177.4(2) . .
N2 C13 C20 C21 2.7(4) . .
C10 Ru C22 C23 81.66(12) . .
C1 Ru C22 C23 -5.69(15) . .
C2 Ru C22 C23 -8.4(3) . .
Cl Ru C22 C23 177.32(10) . .
Cl Ru C22 C23 -98.65(10) 2 .
Ru C22 C23 C24 109.41(17) . .
C10 Ru C23 C22 -102.91(12) . .
C1 Ru C23 C22 175.21(13) . .
C2 Ru C23 C22 176.68(12) . .
Cl Ru C23 C22 -3.62(14) . .
Cl Ru C23 C22 82.95(11) 2 .
C10 Ru C23 C24 139.42(14) . .
C22 Ru C23 C24 -117.67(19) . .
C1 Ru C23 C24 57.54(15) . .
C2 Ru C23 C24 59.01(16) . .
Cl Ru C23 C24 -121.29(12) . .
Cl Ru C23 C24 -34.72(14) 2 .
C25 O2 C24 O1 4.5(3) . .
C25 O2 C24 C23 -177.76(17) . .
C22 C23 C24 O1 -179.27(18) . .
Ru C23 C24 O1 -97.54(19) . .
C22 C23 C24 O2 3.0(2) . .
Ru C23 C24 O2 84.75(16) . .
C3S C1S C2S C3S -0.2(5) 2_656 .
C1S C2S C3S C1S 0.2(5) . 2_656
