Synthesis and Reactivity of a Bis(disulfide)-Bridged RuMo3S4 Double-Cubane Cluster: A New Family of Nona- or Decanuclear Mixed-Metal Sulfide Clusters with Two RuMo3S4 Units
Izuru Takei; Koji Kobayashi; Keita Dohki; Masanobu Hidai; Inorganic Chemistry 46 (2007) 1045–1047; doi:10.1021/ic0621953

data_4307699
_publ_section_title
;
Synthesis and Reactivity of a Bis(disulfide)-Bridged RuMo3S4 Double-Cubane
Cluster: A New Family of Nona- or Decanuclear Mixed-Metal Sulfide
Clusters with Two RuMo3S4 Units
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1045
_journal_page_last               1047
_journal_paper_doi               10.1021/ic0621953
_journal_volume                  46
_journal_year                    2007
_chemical_formula_moiety         'C66 H102 F12 Mo6 O2 P2 Ru2 S12 '
_chemical_formula_sum            'C66 H102 F12 Mo6 O2 P2 Ru2 S12'
_chemical_formula_weight         2379.96
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.0000
_cell_angle_beta                 108.1390(16)
_cell_angle_gamma                90.0000
_cell_formula_units_Z            4
_cell_length_a                   17.927(7)
_cell_length_b                   30.512(11)
_cell_length_c                   17.102(6)
_cell_measurement_reflns_used    12913
_cell_measurement_temperature    293.1
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.0
_cell_volume                     8890(6)
_computing_cell_refinement       CrystalClear
_computing_data_collection       CrystalClear
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure 3.8.0'
_computing_structure_refinement  CRYSTALS
_computing_structure_solution    'DIRDIF99 (PATTY)'
_diffrn_detector_area_resol_mean 7.31
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Rigaku Mercury'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.082
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -23
_diffrn_reflns_limit_k_max       39
_diffrn_reflns_limit_k_min       -39
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            67364
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_exptl_absorpt_coefficient_mu    1.528
_exptl_absorpt_correction_T_max  0.858
_exptl_absorpt_correction_T_min  0.603
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.778
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             4736.00
_exptl_crystal_size_max          0.90
_exptl_crystal_size_mid          0.45
_exptl_crystal_size_min          0.10
_refine_diff_density_max         1.58
_refine_diff_density_min         -1.62
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.025
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     962
_refine_ls_number_reflns         20233
_refine_ls_R_factor_gt           0.0568
_refine_ls_shift/su_max          0.0064
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[0.0010Fo^2^ + 0.3800\s(Fo^2^) + 0.0400]/(4Fo^2^)'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.1956
_reflns_number_gt                7396
_reflns_number_total             20233
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            ic0621953si20061117_025226.cif
_cod_data_source_block           '__clust2'
_cod_original_formula_sum        'C66 H102 F12 Mo6 O2 P2 Ru2 S12 '
_cod_database_code               4307699