Unusual Coordination Assemblies from Platinum(II) Thienyl and Bithienyl Complexes
Peili Teo; L. L. Koh; T. S. Andy Hor; Inorganic Chemistry 42 (2003) 7290–7296; doi:10.1021/ic034690u

data_4312430
_publ_section_title
;
 Unusual Coordination Assemblies from Platinum(II) Thienyl and Bithienyl
 Complexes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              7290
_journal_page_last               7296
_journal_paper_doi               10.1021/ic034690u
_journal_volume                  42
_journal_year                    2003
_chemical_formula_sum            'C42 H34 Cl9 F3 Fe O3 P2 Pt S2'
_chemical_formula_weight         1339.74
_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                99.2230(10)
_cell_angle_beta                 100.7800(10)
_cell_angle_gamma                97.7680(10)
_cell_formula_units_Z            4
_cell_length_a                   14.0474(9)
_cell_length_b                   14.3402(9)
_cell_length_c                   26.0749(17)
_cell_measurement_temperature    223(2)
_cell_volume                     5018.8(6)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      223(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_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  0.0811
_diffrn_reflns_av_sigmaI/netI    0.0932
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            53003
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.62
_exptl_absorpt_coefficient_mu    3.748
_exptl_crystal_density_diffrn    1.773
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             2624
_refine_diff_density_max         2.245
_refine_diff_density_min         -2.853
_refine_diff_density_rms         0.186
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.063
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1198
_refine_ls_number_reflns         17653
_refine_ls_number_restraints     120
_refine_ls_restrained_S_all      1.066
_refine_ls_R_factor_all          0.0968
_refine_ls_R_factor_gt           0.0673
_refine_ls_shift/su_max          0.011
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0604P)^2^+39.2267P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1463
_refine_ls_wR_factor_ref         0.1572
_reflns_number_gt                12934
_reflns_number_total             17653
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic034690usi20030619_111455.cif
_cod_data_source_block           3033
_cod_database_code               4312430