Clusters [Co(As3S3)2]2-, [Ni(As3S3)2]2-, and [{Co(en)}6(μ3-S)4(AsS3)4]2- with Co-As or Ni-As Bonds: Solvothermal Syntheses and Characterizations of Thioarsenates Containing Transition-Metal Complexes
Chunying Tang; Fang Wang; Wenqing Jiang; Yong Zhang; Dingxian Jia; Inorganic Chemistry 52 (2013) 10860–10868; doi:10.1021/ic4007982

data_4336148
_publ_contact_author_address
;Soochow University
      College of Chemistry, Chemical Engineering and Materials Science
      P.O. Box 174, Renai Road 199, Suzhou 215123
      P.R.China.
;
_publ_contact_author_email       jiadingxian@suda.edu.cn
_publ_contact_author_fax         86-512-65880089
_publ_contact_author_name        'Dr. Dingxian Jia'
_publ_contact_author_phone       86-512-65880089
_publ_section_title
;
 Clusters [Co(As3S3)2]2-, [Ni(As3S3)2]2-, and [{Co(en)}6(\m3-S)4(AsS3)4]2-
 with Co-As or Ni-As Bonds: Solvothermal Syntheses and Characterizations
 of Thioarsenates Containing Transition-Metal Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              10860
_journal_page_last               10868
_journal_paper_doi               10.1021/ic4007982
_journal_volume                  52
_journal_year                    2013
_chemical_formula_moiety         'C8 H26 As6 Co2 N6 S6'
_chemical_formula_sum            'C8 H26 As6 Co2 N6 S6'
_chemical_formula_weight         966.09
_chemical_name_systematic
; 
 ? 
;
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_cell_measurement_theta_max      25.35
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_computing_cell_refinement       CrystalClear
_computing_data_collection       CrystalClear
_computing_data_reduction        CrystalStructure
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      223(2)
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_diffrn_measured_fraction_theta_full 0.995
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_diffrn_measurement_device_type  'Rigaku Saturn'
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_diffrn_reflns_limit_l_min       -18
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_diffrn_reflns_theta_max         25.35
_diffrn_reflns_theta_min         3.04
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_exptl_absorpt_correction_T_max  0.1199
_exptl_absorpt_correction_T_min  0.0509
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Jacobson, R. (1998) Private communication'
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_exptl_crystal_description       block
_exptl_crystal_F_000             1856
_exptl_crystal_size_max          0.80
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_refine_diff_density_max         1.363
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_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.039(14)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.913
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_refine_ls_number_parameters     254
_refine_ls_number_reflns         4857
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_refine_ls_restrained_S_all      0.913
_refine_ls_R_factor_all          0.0396
_refine_ls_R_factor_gt           0.0341
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0298P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0727
_refine_ls_wR_factor_ref         0.0751
_reflns_number_gt                4001
_reflns_number_total             4857
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic4007982_si_002_2.cif
_cod_data_source_block           compound_1
_cod_original_cell_volume        2687.6(9)
_cod_database_code               4336148