μ~2~-Iodido-bis{dimethyl[methylbis(quinolin-8-yl)silanyl-κ^3^<i>N</i>,<i>Si</i>,<i>N</i>']platinum(IV)} tetrakis(pentafluorophenyl)borate dichloromethane 0.66-solvate
Carr, C. A. Marcus; Gribble, Christopher W.; Gibson, Marcus I.; Acta Crystallographica Section E 64 (2008) m472–; doi:10.1107/S160053680800319X

data_2217719
_publ_section_title
;\m~2~-Iodido-bis{dimethyl[methylbis(quinolin-8-yl)silanyl-\k^3^<i>N</i>,<i>Si</i>,<i>N</i>']platinum(IV)}
 tetrakis(pentafluorophenyl)borate dichloromethane 0.66-solvate
;
_journal_coeditor_code           BH2154
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m472
_journal_paper_doi               10.1107/S160053680800319X
_journal_volume                  64
_journal_year                    2008
_chemical_formula_iupac
'[Pt2 (C H3)4 (C19 H15 N 2 Si)2 I] (C24 F20 B), 0.66C H2 Cl2'
_chemical_formula_moiety
'C42 H42 I N4 Pt2 Si2 +, C24 B F20 -, 0.66(C H2 Cl2)'
_chemical_formula_sum            'C66.66 H43.32 B Cl1.32 F20 I N4 Pt2 Si2'
_chemical_formula_weight         1911.14
_chemical_name_systematic
;
\m~2~-Iodido-bis{dimethyl[methylbis(quinolin-8-yl)silanyl-
\k^3^N,Si,N']platinum(IV)} tetrakis(pentafluorophenyl)borate dichloromethane
0.66-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'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL97
_cell_angle_alpha                71.9300(10)
_cell_angle_beta                 72.0450(10)
_cell_angle_gamma                87.6210(10)
_cell_formula_units_Z            2
_cell_length_a                   13.9051(10)
_cell_length_b                   15.3559(11)
_cell_length_c                   17.1261(12)
_cell_measurement_reflns_used    30538
_cell_measurement_temperature    167(2)
_cell_measurement_theta_max      26.39
_cell_measurement_theta_min      2.14
_cell_volume                     3301.3(4)
_computing_cell_refinement       'XPREP (Bruker, 2001)'
_computing_data_collection       'SMART (Bruker, 2002)'
_computing_data_reduction        'SAINT (Bruker, 2002)'
_computing_molecular_graphics
;
ORTEP-3 (Farrugia, 1997) and POV-RAY (Cason, 2002)
;
_computing_publication_material  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      167(2)
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  'Bruker APEX CCD'
_diffrn_measurement_method       \w
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0204
_diffrn_reflns_av_sigmaI/netI    0.0305
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            30538
_diffrn_reflns_theta_full        26.39
_diffrn_reflns_theta_max         26.39
_diffrn_reflns_theta_min         2.14
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    4.892
_exptl_absorpt_correction_T_max  0.710
_exptl_absorpt_correction_T_min  0.530
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker, 2002)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.921
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1831.4
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.07
_refine_diff_density_max         0.945
_refine_diff_density_min         -0.714
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.084
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     898
_refine_ls_number_reflns         13293
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.084
_refine_ls_R_factor_all          0.0338
_refine_ls_R_factor_gt           0.0252
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0365P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0629
_refine_ls_wR_factor_ref         0.0651
_reflns_number_gt                11270
_reflns_number_total             13293
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            bh2154.cif
_cod_data_source_block           I
_cod_database_code               2217719
_cod_database_fobs_code          2217719