Bis(cyclohexylammonium) tetrachloridodiphenylstannate(IV)
Sarr, Modou; Merkens, Carina; Diassé-Sarr, Aminata; Diop, Libasse; Englert, Ulli; Acta Crystallographica Section E 70 (2014) m220–m221; doi:10.1107/S160053681401109X

data_2239575
_publ_section_title
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 Bis(cyclohexylammonium) tetrachloridodiphenylstannate(IV)
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_journal_coeditor_code           WM5023
_journal_issue                   6
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m220
_journal_page_last               m221
_journal_paper_doi               10.1107/S160053681401109X
_journal_volume                  70
_journal_year                    2014
_chemical_formula_iupac          '(C6 H14 N)2 [Sn (C6 H5)2 Cl4] '
_chemical_formula_moiety         '2(C6 H14 N +), C12 H10 Cl4 Sn 2-'
_chemical_formula_sum            'C24 H38 Cl4 N2 Sn'
_chemical_formula_weight         615.05
_chemical_name_systematic
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Bis(cyclohexylammonium) tetrachloridodiphenylstannate(IV)
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_space_group_IT_number           43
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'F 2 -2d'
_symmetry_space_group_name_H-M   'F d d 2'
_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            8
_cell_length_a                   13.558(4)
_cell_length_b                   49.646(14)
_cell_length_c                   8.058(2)
_cell_measurement_reflns_used    5810
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      26.15
_cell_measurement_theta_min      2.97
_cell_volume                     5424(3)
_computing_cell_refinement       'SAINT (Bruker, 2009)'
_computing_data_collection       'SMART (Bruker, 2009)'
_computing_data_reduction        'SAINT (Bruker, 2009)'
_computing_molecular_graphics    'PLATON (Spek, 2009)'
_computing_publication_material  'SHELXL-2013 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type
'Bruker D8 goniometer with APEX area detector'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_monochromator  'multilayer optics'
_diffrn_radiation_source         'Incoatec microsource'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0690
_diffrn_reflns_av_sigmaI/netI    0.0803
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       62
_diffrn_reflns_limit_k_min       -62
_diffrn_reflns_limit_l_max       10
_diffrn_reflns_limit_l_min       -10
_diffrn_reflns_number            15474
_diffrn_reflns_theta_full        26.48
_diffrn_reflns_theta_max         26.48
_diffrn_reflns_theta_min         2.97
_exptl_absorpt_coefficient_mu    1.351
_exptl_absorpt_correction_T_max  0.935
_exptl_absorpt_correction_T_min  0.687
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(<i>SADABS</i>; Bruker, 2009)
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.506
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             2512
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.919
_refine_diff_density_min         -0.673
_refine_ls_abs_structure_details 'Flack (1983), 1281 Friedel pairs'
_refine_ls_abs_structure_Flack   0.23(5)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.056
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     151
_refine_ls_number_reflns         2772
_refine_ls_number_restraints     4
_refine_ls_restrained_S_all      1.055
_refine_ls_R_factor_all          0.0469
_refine_ls_R_factor_gt           0.0433
_refine_ls_shift/su_max          0.004
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0200P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0979
_refine_ls_wR_factor_ref         0.0996
_reflns_number_gt                2563
_reflns_number_total             2772
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            wm5023sup1.cf
_cod_data_source_block           I
_cod_database_code               2239575
_cod_database_fobs_code          2239575