<i>cis</i>-Dichloridobis[diphenyl(4-vinylphenyl)phosphane-κ<i>P</i>]platinum(II)
Ogutu, Hezron; Meijboom, Reinout; Acta Crystallographica Section E 67 (2011) m1662–; doi:10.1107/S1600536811043789

data_2232820
_publ_section_title
;
 <i>cis</i>-Dichloridobis[diphenyl(4-vinylphenyl)phosphane-\k<i>P</i>]platinum(II)
;
_journal_coeditor_code           KP2359
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m1662
_journal_paper_doi               10.1107/S1600536811043789
_journal_volume                  67
_journal_year                    2011
_chemical_formula_iupac          '[Pt Cl2 (C20 H17 P)2]'
_chemical_formula_moiety         'C40 H34 Cl2 P2 Pt'
_chemical_formula_sum            'C40 H34 Cl2 P2 Pt'
_chemical_formula_weight         842.6
_chemical_name_systematic
;
<i>cis</i>-Dichloridobis[diphenyl(4-vinylphenyl)phosphane-\k<i>P</i>]
platinum(II)
;
_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           'WinGX routine CIF_UPDATE'
_cell_angle_alpha                100.179(3)
_cell_angle_beta                 97.519(3)
_cell_angle_gamma                108.465(3)
_cell_formula_units_Z            2
_cell_length_a                   10.0670(5)
_cell_length_b                   12.7080(7)
_cell_length_c                   14.4200(7)
_cell_measurement_reflns_used    9915
_cell_measurement_temperature    173
_cell_measurement_theta_max      65.46
_cell_measurement_theta_min      3.18
_cell_volume                     1687.42(16)
_computing_cell_refinement       'SAINT (Bruker, 2004)'
_computing_data_collection       'APEX2 (Bruker, 2005)'
_computing_data_reduction        'SAINT (Bruker, 2004)'
_computing_molecular_graphics    'SHELXTL (Sheldrick, 2008)'
_computing_publication_material  'SHELXTL (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      173
_diffrn_measured_fraction_theta_full 0.963
_diffrn_measured_fraction_theta_max 0.963
_diffrn_measurement_device_type  'Bruker APEXII CCD'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0658
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            33523
_diffrn_reflns_theta_full        66.04
_diffrn_reflns_theta_max         66.04
_diffrn_reflns_theta_min         3.18
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    10.342
_exptl_absorpt_correction_T_max  0.596
_exptl_absorpt_correction_T_min  0.565
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(SADABS; Bruker; 2004)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.658
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       rectagular
_exptl_crystal_F_000             832
_exptl_crystal_size_max          0.09
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.195
_refine_diff_density_min         -0.654
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.077
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     406
_refine_ls_number_reflns         5650
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.077
_refine_ls_R_factor_all          0.0342
_refine_ls_R_factor_gt           0.027
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w = 1/[\s^2^(Fo^2^)+(0.0347P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0645
_reflns_number_gt                5076
_reflns_number_total             5650
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            kp2359.cif
_cod_data_source_block           I
_cod_original_cell_volume        1687.42(15)
_cod_database_code               2232820
_cod_database_fobs_code          2232820