Dichloridobis[3-(4-chlorophenyl)-2,<i>N</i>,<i>N</i>-trimethyl-2,3-dihydro-1,2,4-oxadiazole-5-amine-κ<i>N</i>^4^]platinum(II)–4-chlorobenzaldehyde (1/1)
Kritchenkov, Andreii S.; Gurzhiy, Vladislav V.; Bokach, Nadezhda A.; Kalibabchuk, Valentina A.; Acta Crystallographica Section E 69 (2013) m446–m447; doi:10.1107/S1600536813017376

data_2238423
_publ_section_title
;
 Dichloridobis[3-(4-chlorophenyl)-2,<i>N</i>,<i>N</i>-trimethyl-2,3-dihydro-1,2,4-oxadiazole-5-amine-\k<i>N</i>^4^]platinum(II)--4-chlorobenzaldehyde
 (1/1)
;
_journal_coeditor_code           SJ5329
_journal_issue                   8
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m446
_journal_page_last               m447
_journal_paper_doi               10.1107/S1600536813017376
_journal_volume                  69
_journal_year                    2013
_chemical_formula_iupac          '[Pt Cl2 (C11 H15 Cl1 N3 O1)2], C7 H5 Cl O'
_chemical_formula_moiety         'C22 H30 Cl4 N6 O2 Pt, C7 H5 Cl O'
_chemical_formula_sum            'C29 H35 Cl5 N6 O3 Pt'
_chemical_formula_weight         887.97
_chemical_name_systematic
'Dichloridobis[3-(4-chlorophenyl)-2,<i>N</i>,<i>N</i>-trimethyl-2,3-dihydro-1,2,4-oxadiazole-5-amine-\k<i>N</i>^4^]platinum(II)--4-chlorobenzaldehyde (1/1)'
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_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
;
  Olex2 1.2-ac2
  (compiled 2012.03.27 svn.r2268, GUI svn.r4156)
;
_cell_angle_alpha                101.0381(18)
_cell_angle_beta                 104.9553(19)
_cell_angle_gamma                96.3847(17)
_cell_formula_units_Z            1
_cell_length_a                   8.46436(18)
_cell_length_b                   9.38481(19)
_cell_length_c                   11.4373(3)
_cell_measurement_reflns_used    9801
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      31.6786
_cell_measurement_theta_min      2.5221
_cell_volume                     849.08(4)
_computing_cell_refinement       'CrysAlis PRO (Agilent, 2012)'
_computing_data_collection       'CrysAlis PRO (Agilent, 2012)'
_computing_data_reduction        'CrysAlis PRO (Agilent, 2012)'
_computing_molecular_graphics    'OLEX2 (Dolomanov <i>et al.</i>, 2009)'
_computing_publication_material  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SIR2004 (Burla <i>et al.</i>, 2005)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 16.2096
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Agilent Xcalibur Eos'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0361
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            13908
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         2.53
_exptl_absorpt_coefficient_mu    4.565
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.93264
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(DENZO/SCALEPACK; Otwinowski & Minor, 1997)'
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.737
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             438
_exptl_crystal_size_max          0.17
_exptl_crystal_size_mid          0.11
_exptl_crystal_size_min          0.09
_refine_diff_density_max         1.627
_refine_diff_density_min         -1.214
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.062
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     211
_refine_ls_number_reflns         3892
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.062
_refine_ls_R_factor_all          0.0224
_refine_ls_R_factor_gt           0.0223
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0326P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0534
_refine_ls_wR_factor_ref         0.0535
_reflns_number_gt                3888
_reflns_number_total             3892
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            sj5329.cif
_cod_data_source_block           I
_cod_original_cell_volume        849.07(3)
_cod_database_code               2238423
_cod_database_fobs_code          2238423