Aggregation of the Half-Sandwich Trisulfido Complex of Tungsten with Silver Ions: Synthesis of a Cyanide-Bridged Helical Polymer {[(η5-C5Me5)WS3]2Ag3(CN)}∞and a Cyclic Cluster [(η5-C5Me5)WS3Ag]4
Jian-Ping Lang; Kazuyuki Tatsumi; Inorganic Chemistry 38 (1999) 1364–1367; doi:10.1021/ic980883j

data_4321830
_publ_section_title
;
 Aggregation of the Half-Sandwich Trisulfido Complex of Tungsten with
 Silver Ions: Synthesis of a Cyanide-Bridged Helical Polymer
 {[(\h5-C5Me5)WS3]2Ag3(CN)}\\infty and a Cyclic Cluster
 [(\h5-C5Me5)WS3Ag]4
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1364
_journal_page_last               1367
_journal_paper_doi               10.1021/ic980883j
_journal_volume                  38
_journal_year                    1999
_chemical_formula_moiety         'C10 H15 Ag S3 W '
_chemical_formula_sum            'C10 H15 Ag S3 W'
_chemical_formula_weight         523.13
_space_group_IT_number           114
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      114
_symmetry_space_group_name_Hall  'P -4 2n'
_symmetry_space_group_name_H-M   'P -4 21 c'
_audit_creation_date             'Thu Oct 29 10:53:21 1998'
_audit_creation_method           'from TEXRAY.INF file'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   17.824(5)
_cell_length_b                   17.824(5)
_cell_length_c                   8.558(3)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    296.2
_cell_measurement_theta_max      14.9
_cell_measurement_theta_min      3.2
_cell_volume                     2718.8(14)
_computing_cell_refinement       'Rigaku/AFC Diffractometer Control'
_computing_data_collection       'Rigaku/AFC Diffractometer Control'
_computing_data_reduction        teXsan
_computing_publication_material  teXsan
_computing_structure_refinement  teXsan
_computing_structure_solution    SHELXS86
_diffrn_ambient_temperature      296.2
_diffrn_measurement_device_type  'Rigaku AFC7R'
_diffrn_measurement_method       \w-2\q
_diffrn_orient_matrix_UB_11      0.03484
_diffrn_orient_matrix_UB_12      0.04393
_diffrn_orient_matrix_UB_13      -0.00410
_diffrn_orient_matrix_UB_21      0.04348
_diffrn_orient_matrix_UB_22      -0.03482
_diffrn_orient_matrix_UB_23      -0.01401
_diffrn_orient_matrix_UB_31      -0.00646
_diffrn_orient_matrix_UB_32      0.00274
_diffrn_orient_matrix_UB_33      -0.11593
_diffrn_radiation_detector       'scintillation counter'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Rigaku rotating anode'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.000
_diffrn_reflns_av_sigmaI/netI    0.044
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       25
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            2318
_diffrn_reflns_reduction_process 'Lp corrections applied'
_diffrn_reflns_theta_max         30.02
_diffrn_reflns_theta_min         2.29
_diffrn_standards_decay_%        0.25
_diffrn_standards_interval_count 150
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    10.328
_exptl_absorpt_correction_T_max  0.998
_exptl_absorpt_correction_T_min  0.551
_exptl_absorpt_correction_type   psi-scan
_exptl_absorpt_process_details   '(North, Phillips & Mathews, 1968)'
_exptl_crystal_colour            dark
_exptl_crystal_density_diffrn    2.556
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             1952.00
_exptl_crystal_size_max          0.700
_exptl_crystal_size_mid          0.300
_exptl_crystal_size_min          0.100
_refine_diff_density_max         4.14
_refine_diff_density_min         -3.44
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   2.450
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_constraints    0
_refine_ls_number_parameters     136
_refine_ls_number_reflns         1696
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0000
_refine_ls_R_factor_gt           0.0000
_refine_ls_shift/su_max          0.0040
_refine_ls_shift/su_mean         0.0000
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[\s^2^(Fo) + 0.00032|Fo|^2^]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0000
_refine_ls_wR_factor_ref         0.0732
_reflns_number_gt                0
_reflns_number_total             2318
_reflns_threshold_expression     >2.0sigma(I)
_cod_data_source_file            ic980883j_2.cif
_cod_data_source_block           '[(h5-C5Me5)WS3Ag]4'
_cod_original_cell_volume        2719.0(9)
_cod_original_sg_symbol_H-M      'P -4 21 c '
_cod_original_formula_sum        'C10 H15 Ag S3 W '
_cod_database_code               4321830