<i>trans</i>-Bis(2-amino-6-nitro-1,3-benzothiazole-<i>N</i>)dichloroplatinum(II) tetrakis(<i>N</i>,<i>N</i>'-dimethylformamide) solvate and tetrakis(2-amino-5-methyl-1,3,4-thiadiazole-<i>N</i>^4^)platinum(II) hexachloroplatinate(IV) bis(<i>N</i>,<i>N</i>'-dimethylformamide) solvate
Daniel E. Lynch; Helen L. Duckhouse; Acta Crystallographica Section C 57 (2001) 1036–1038; doi:10.1107/S0108270101009933

data_2012211
_publ_section_title
;<i>trans</i>-Bis(2-amino-6-nitro-1,3-benzothiazole-<i>N</i>)dichloroplatinum(II)
 tetrakis(<i>N</i>,<i>N</i>'-dimethylformamide) solvate and
 tetrakis(2-amino-5-methyl-1,3,4-thiadiazole-<i>N</i>^4^)platinum(II)
 hexachloroplatinate(IV) bis(<i>N</i>,<i>N</i>'-dimethylformamide) solvate
;
_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1036
_journal_page_last               1038
_journal_paper_doi               10.1107/S0108270101009933
_journal_volume                  57
_journal_year                    2001
_chemical_formula_iupac          '[Pt (C3 H5 N3 S)4] [Pt Cl6], 2C3 H7 N O'
_chemical_formula_moiety         'C12 H20 N12 Pt S4 2+, 2C3 H7 N O, Cl6 Pt 2-'
_chemical_formula_sum            'C18 H34 Cl6 N14 O2 Pt2 S4'
_chemical_formula_weight         604.86
_chemical_name_systematic
;
Tetrakis(2-amino-5-methyl-1,3,4-thiadiazole-N^4^)platinum(II)
hexachloroplatinate(IV) bis(N,N'-dimethylformamide) solvate
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_audit_creation_method           SHELXL-97
_cell_angle_alpha                109.027(2)
_cell_angle_beta                 91.850(3)
_cell_angle_gamma                91.785(3)
_cell_formula_units_Z            1
_cell_length_a                   9.0397(4)
_cell_length_b                   9.3009(4)
_cell_length_c                   11.5241(5)
_cell_measurement_reflns_used    4414
_cell_measurement_temperature    150(2)
_cell_measurement_theta_max      27.48
_cell_measurement_theta_min      2.91
_cell_volume                     914.61(7)
_computing_cell_refinement       'DENZO and COLLECT'
_computing_data_collection
'DENZO (Otwinowski & Minor, 1997) and COLLECT (Hooft, 1998)'
_computing_data_reduction        'DENZO and COLLECT'
_computing_molecular_graphics    'PLATON97 (Spek, 1997)'
_computing_publication_material  SHELXL97
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      150(2)
_diffrn_detector_area_resol_mean 9.091
_diffrn_measured_fraction_theta_full .92
_diffrn_measured_fraction_theta_max .92
_diffrn_measurement_device_type  'Enraf-Nonius KappaCCD area-detector'
_diffrn_measurement_method       '\f and \w'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Enraf Nonius FR591 rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     .71073
_diffrn_reflns_av_R_equivalents  .0499
_diffrn_reflns_av_sigmaI/netI    .0831
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            6735
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.00
_diffrn_standards_decay_%        0
_exptl_absorpt_coefficient_mu    8.349
_exptl_absorpt_correction_T_max  .921
_exptl_absorpt_correction_T_min  .573
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SORTAV; Blessing, 1995)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    2.196
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             578
_exptl_crystal_size_max          .08
_exptl_crystal_size_mid          .03
_exptl_crystal_size_min          .01
_refine_diff_density_max         2.38
_refine_diff_density_min         -2.59
_refine_ls_extinction_coef       .0032(6)
_refine_ls_extinction_method     SHELXL97
_refine_ls_goodness_of_fit_ref   1.067
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     216
_refine_ls_number_reflns         3838
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.067
_refine_ls_R_factor_all          .0690
_refine_ls_R_factor_gt           .0478
_refine_ls_shift/su_max          <0.001
_refine_ls_shift/su_mean         <0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w = 1/[\s^2^(Fo^2^)+(0.0370P)^2^+8.3603P] where P = (Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         .1352
_reflns_number_gt                2804
_reflns_number_total             3838
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            gg1066.cif
_cod_data_source_block           II
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_database_code               2012211
_cod_database_fobs_code          2012211