<i>catena</i>-Poly[[(2-amino-5-chlorobenzenesulfonato-κ^2^<i>N</i>,<i>O</i>)silver(I)]-μ-2,5-dimethylpyrazine-κ^2^<i>N</i>:<i>N</i>']
Hai-Yan Liu; Ji-Cheng Ma; Jin Yang; Acta Crystallographica Section E 63 (2007) m2700–m2700; doi:10.1107/S1600536807048957

data_2215798
_publ_section_title
<i>catena</i>-Poly[[(2-amino-5-chlorobenzenesulfonato-\k^2^<i>N</i>,<i>O</i>)silver(I)]-\m-2,5-dimethylpyrazine-\k^2^<i>N</i>:<i>N</i>']
_journal_coeditor_code           BT2528
_journal_issue                   11
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m2700
_journal_page_last               m2700
_journal_paper_doi               10.1107/S1600536807048957
_journal_volume                  63
_journal_year                    2007
_chemical_formula_iupac          '[Ag (C6 H5 Cl N O3 S) (C6 H8 N2)]'
_chemical_formula_moiety         'C12 H13 Ag Cl N3 O3 S'
_chemical_formula_sum            'C12 H13 Ag Cl N3 O3 S'
_chemical_formula_weight         422.63
_chemical_name_systematic
;
catena-Poly[[(2-amino-5-chlorobenzenesulfonato-\k^2^N,O)silver(I)]-\m-
2,5-dimethylpyrazine-\k^2^N:N']
;
_space_group_IT_number           33
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.671(3)
_cell_length_b                   11.947(2)
_cell_length_c                   8.2025(16)
_cell_measurement_reflns_used    10124
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.0
_cell_volume                     1437.7(5)
_computing_cell_refinement       'PROCESS-AUTO (Rigaku, 1998)'
_computing_data_collection       'PROCESS-AUTO (Rigaku, 1998)'
_computing_data_reduction        'PROCESS-AUTO (Rigaku, 1998)'
_computing_molecular_graphics    'SHELXTL-Plus (Sheldrick, 1990)'
_computing_publication_material  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 10.0
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID'
_diffrn_measurement_method       \w
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0342
_diffrn_reflns_av_sigmaI/netI    0.0309
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       8
_diffrn_reflns_limit_l_min       -10
_diffrn_reflns_number            11475
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         3.01
_exptl_absorpt_coefficient_mu    1.745
_exptl_absorpt_correction_T_max  0.906
_exptl_absorpt_correction_T_min  0.653
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(ABSCOR; Higashi, 1995)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.953
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       platelet
_exptl_crystal_F_000             840
_exptl_crystal_size_max          0.319
_exptl_crystal_size_mid          0.225
_exptl_crystal_size_min          0.056
_refine_diff_density_max         0.367
_refine_diff_density_min         -0.334
_refine_ls_abs_structure_details 'Flack (1983), 1172 Friedel pairs'
_refine_ls_abs_structure_Flack   -0.03(3)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.053
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     200
_refine_ls_number_reflns         2935
_refine_ls_number_restraints     4
_refine_ls_restrained_S_all      1.053
_refine_ls_R_factor_all          0.0304
_refine_ls_R_factor_gt           0.0254
_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^)+(0.0213P)^2^+0.3336P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0509
_refine_ls_wR_factor_ref         0.0527
_reflns_number_gt                2638
_reflns_number_total             2935
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            bt2528.cif
_cod_data_source_block           I
_cod_database_code               2215798
_cod_database_fobs_code          2215798