A stable thiolato-Cu<sup>I</sup>-thiolato triple linkage that bridges two cobalt(iii) centres.
Oya, Naoyuki; Yamada, Mihoko; Surinwong, Sireenart; Kuwamura, Naoto; Konno, Takumi; Dalton transactions (Cambridge, England : 2003) 47 (2018) 2497–2500; doi:10.1039/c7dt04760f

data_7045443
_publ_section_title
;
 A stable thiolato-Cu<sup>I</sup>-thiolato triple linkage that bridges two
 cobalt(iii) centres.
;
_journal_issue                   8
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2497
_journal_page_last               2500
_journal_paper_doi               10.1039/c7dt04760f
_journal_volume                  47
_journal_year                    2018
_chemical_absolute_configuration rmad
_chemical_formula_sum            'C34 H84 Co2 Cu3 N6 Na3 O23 S6'
_chemical_formula_weight         1514.88
_space_group_crystal_system      monoclinic
_space_group_IT_number           5
_space_group_name_Hall           'C 2y'
_space_group_name_H-M_alt        'C 1 2 1'
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_atom_sites_solution_hydrogens   mixed
_audit_creation_method           SHELXL-2014
_audit_update_record
;
2018-01-11 deposited with the CCDC.
2018-01-15 downloaded from the CCDC.
;
_cell_angle_alpha                90
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_cell_volume                     3133.7(9)
_computing_cell_refinement       'RAPID AUTO'
_computing_data_collection       'RAPID AUTO (Rigaku, ????)'
_computing_data_reduction        'RAPID AUTO'
_computing_molecular_graphics    Mercury
_computing_publication_material  WinGX
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_diffrn_ambient_temperature      200(2)
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_diffrn_measurement_device_type  'Rigaku R-AXIS VII'
_diffrn_measurement_method       \w
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71075
_diffrn_reflns_av_R_equivalents  0.0395
_diffrn_reflns_av_unetI/netI     0.0889
_diffrn_reflns_Laue_measured_fraction_full 0.997
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_diffrn_reflns_limit_l_max       17
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_diffrn_reflns_number            12525
_diffrn_reflns_point_group_measured_fraction_full 0.979
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_diffrn_reflns_theta_max         27.482
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_diffrn_source                   'rotating-anode X-ray tube'
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_exptl_absorpt_correction_type   multi-scan
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_exptl_crystal_colour            'dark purple'
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_exptl_crystal_description       plate
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_refine_diff_density_min         -0.446
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_refine_ls_abs_structure_details
;
 Flack x determined using 2089 quotients [(I+)-(I-)]/[(I+)+(I-)]
 (Parsons, Flack and Wagner, Acta Cryst. B69 (2013) 249-259).
;
_refine_ls_abs_structure_Flack   0.053(9)
_refine_ls_extinction_method     none
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_refine_ls_hydrogen_treatment    constr
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_refine_ls_R_factor_all          0.0666
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0280P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0756
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_reflns_Friedel_fraction_max     0.918
_reflns_number_gt                5761
_reflns_number_total             6916
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c7dt04760f2.cif
_cod_data_source_block           Na3[1]
_cod_depositor_comments
'Adding full bibliography for 7045443--7045444.cif.'
_cod_original_cell_volume        3133.7(8)
_cod_database_code               7045443
_shelx_estimated_absorpt_t_min   0.839
_shelx_estimated_absorpt_t_max   0.965
_shelxl_version_number           2014-3
_shelx_res_checksum              60044