A novel structural rearrangement reaction of dialkylated derivatives of [Pt(2)(μ-S)(2)(PPh(3))(4)] involving Pt-C bond formation.
Ujam, Oguejiofo T.; Devoy, Sarah M.; Henderson, William; Nicholson, Brian K.; Hor, T. S. Andy; Dalton transactions (Cambridge, England : 2003) 41 (2012) 12773–12780; doi:10.1039/c2dt31637d

data_7020466
_publ_section_title
;
 A novel structural rearrangement reaction of dialkylated derivatives of
 [Pt(2)(\m-S)(2)(PPh(3))(4)] involving Pt-C bond formation.
;
_journal_issue                   41
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              12773
_journal_page_last               12780
_journal_paper_doi               10.1039/c2dt31637d
_journal_volume                  41
_journal_year                    2012
_chemical_formula_moiety         'C63 H52 Cl1 N4 O4 P3 Pt2 S2, C1 H2 Cl2'
_chemical_formula_sum            'C64 H54 Cl3 N4 O4 P3 Pt2 S2'
_chemical_formula_weight         1596.67
_chemical_name_systematic
;
?
;
_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           SHELXL-97
_cell_angle_alpha                112.021(2)
_cell_angle_beta                 106.941(2)
_cell_angle_gamma                90.752(3)
_cell_formula_units_Z            2
_cell_length_a                   13.1803(8)
_cell_length_b                   15.4820(10)
_cell_length_c                   19.2062(14)
_cell_measurement_reflns_used    7709
_cell_measurement_temperature    93(2)
_cell_measurement_theta_max      28
_cell_measurement_theta_min      2
_cell_volume                     3442.3(4)
_computing_cell_refinement       'APEXII v1.0-27 '
_computing_data_collection       'APEXII v1.0-27 '
_computing_data_reduction        'APEXII v1.0-27 '
_computing_molecular_graphics    'ORTEP-3 for Windows and Mercury 3.0'
_computing_publication_material  'WinGX v1.64.05 (Farrugia, 2003)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      93(2)
_diffrn_measured_fraction_theta_full 0.965
_diffrn_measured_fraction_theta_max 0.965
_diffrn_measurement_device_type  'Bruker APEXII CCD area detector'
_diffrn_measurement_method       '\f and \w scans'
_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  0.0609
_diffrn_reflns_av_sigmaI/netI    0.0873
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            35154
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.21
_exptl_absorpt_coefficient_mu    4.352
_exptl_absorpt_correction_T_max  0.9578
_exptl_absorpt_correction_T_min  0.6232
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.540
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'thin plate'
_exptl_crystal_F_000             1564
_exptl_crystal_size_max          0.12
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.01
_platon_squeeze_details          ' ?'
_refine_diff_density_max         5.280
_refine_diff_density_min         -3.237
_refine_diff_density_rms         0.332
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.157
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     719
_refine_ls_number_reflns         11716
_refine_ls_number_restraints     531
_refine_ls_restrained_S_all      1.132
_refine_ls_R_factor_all          0.0911
_refine_ls_R_factor_gt           0.0614
_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^)+(0.0891P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1608
_refine_ls_wR_factor_ref         0.1716
_reflns_number_gt                8014
_reflns_number_total             11716
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2dt31637d.txt
_cod_data_source_block           sdnpsq
_cod_database_code               7020466