Novel Aggregation of Bis(thiolato)-type Cobalt(III) Octahedra Assisted by Silver(I) Ions: Structural Interconversion by Counter Anions
Konno, Takumi; Aridomi, Takashi; Hattori, Masashi; Hirotsu, Masakazu; Chemistry Letters 35 (2006) 316–; doi:10.1246/cl.2006.316

data_8000104
_publ_section_title
;
 Novel Aggregation of Bis(thiolato)-type Cobalt(III) Octahedra Assisted by
 Silver(I) Ions: Structural Interconversion by Counter Anions
;
_journal_issue                   3
_journal_name_full               'Chemistry Letters'
_journal_page_first              316
_journal_paper_doi               10.1246/cl.2006.316
_journal_volume                  35
_journal_year                    2006
_chemical_formula_moiety         'C24 H94 Ag4 Cl8 Co4 N16 O39 S8 '
_chemical_formula_sum            'C24 H94 Ag4 Cl8 Co4 N16 O39 S8'
_chemical_formula_weight         2438.40
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_audit_creation_date             2005-11-26
_audit_creation_method           'by CrystalStructure 3.6.0'
_cell_angle_alpha                96.01(1)
_cell_angle_beta                 104.77(2)
_cell_angle_gamma                75.38(2)
_cell_formula_units_Z            1
_cell_length_a                   12.751(3)
_cell_length_b                   16.982(3)
_cell_length_c                   9.711(2)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    296.1
_cell_measurement_theta_max      14.9
_cell_measurement_theta_min      12.7
_cell_volume                     1965.6(7)
_computing_cell_refinement       'MSC/AFC Diffractometer Control'
_computing_data_collection       'MSC/AFC Diffractometer Control'
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure 3.6.0'
_computing_structure_refinement  CRYSTALS
_computing_structure_solution    SIR92
_diffrn_measured_fraction_theta_full 0.9944
_diffrn_measured_fraction_theta_max 0.9944
_diffrn_measurement_device_type  'Rigaku AFC7S'
_diffrn_measurement_method       \w-2\q
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.053
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       22
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            9449
_diffrn_reflns_theta_full        27.55
_diffrn_reflns_theta_max         27.55
_diffrn_standards_decay_%        0.37
_diffrn_standards_interval_count 0
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    2.372
_exptl_absorpt_correction_T_max  0.701
_exptl_absorpt_correction_T_min  0.621
_exptl_absorpt_correction_type   psi-scans
_exptl_absorpt_process_details   '(North, Phillips & Mathews, 1968)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    2.060
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             1222.00
_exptl_crystal_size_max          0.23
_exptl_crystal_size_mid          0.23
_exptl_crystal_size_min          0.15
_refine_diff_density_max         2.81
_refine_diff_density_min         -3.07
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.682
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     504
_refine_ls_number_reflns         9039
_refine_ls_R_factor_gt           0.0540
_refine_ls_shift/su_max          0.0000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[0.0010Fo^2^ + 3.0000\s(Fo^2^) + 0.5000]/(4Fo^2^)'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.1470
_reflns_number_gt                4677
_reflns_number_total             9039
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            35-316sup1.cif
_cod_data_source_block           '[2](ClO4)8'
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2018-09-03
;
_cod_original_cell_volume        1965.6(6)
_cod_original_sg_symbol_Hall     -p_1
_cod_original_sg_symbol_H-M      p_-1
_cod_original_formula_sum        'C24 H94 Ag4 Cl8 Co4 N16 O39 S8 '
_cod_database_code               8000104