Terpyridine platinum(II) complexes containing triazine di- or tri-thiolate bridges: structures, luminescence, electrochemistry, and aggregation.
Zhang, Hua-Xin; Kato, Masako; Sasaki, Yoichi; Ohba, Tadashi; Ito, Hiroto; Kobayashi, Atsushi; Chang, Ho-Chol; Uosaki, Kohei; Dalton transactions (Cambridge, England : 2003) 41 (2012) 11497–11506; doi:10.1039/c2dt30997a

data_7030216
_publ_section_title
;
 Terpyridine platinum(II) complexes containing triazine di- or
 tri-thiolate bridges: structures, luminescence, electrochemistry, and
 aggregation.
;
_journal_issue                   37
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              11497
_journal_page_last               11506
_journal_paper_doi               10.1039/c2dt30997a
_journal_volume                  41
_journal_year                    2012
_chemical_formula_moiety         'C47 H52 F12 N10 O2 P2 Pt2 S2 '
_chemical_formula_sum            'C47 H52 F12 N10 O2 P2 Pt2 S2'
_chemical_formula_weight         1533.22
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.0000(4)
_cell_angle_beta                 132.9798(5)
_cell_angle_gamma                90.0000(4)
_cell_formula_units_Z            4
_cell_length_a                   19.593(4)
_cell_length_b                   27.255(5)
_cell_length_c                   13.952(3)
_cell_measurement_reflns_used    6758
_cell_measurement_temperature    150.1
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.2
_cell_volume                     5450.7(19)
_computing_cell_refinement       CrystalClear
_computing_data_collection       CrystalClear
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure 3.8'
_computing_structure_refinement  SHELXL
_computing_structure_solution    SIR2004
_diffrn_ambient_temperature      150.1
_diffrn_detector_area_resol_mean 7.31
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.992
_diffrn_measurement_device_type  'Rigaku Mercury'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71070
_diffrn_reflns_av_R_equivalents  0.049
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_h_min       -25
_diffrn_reflns_limit_k_max       35
_diffrn_reflns_limit_k_min       -35
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -11
_diffrn_reflns_number            18577
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_exptl_absorpt_coefficient_mu    5.332
_exptl_absorpt_correction_T_max  0.587
_exptl_absorpt_correction_T_min  0.351
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details
;
Higashi, T. (1999). Program for Absorption Correction.
Rigaku Corporation, Tokyo, Japan.
;
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    1.868
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             2984.00
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.10
_refine_diff_density_max         3.13
_refine_diff_density_min         -1.88
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.092
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     353
_refine_ls_number_reflns         6203
_refine_ls_R_factor_gt           0.0386
_refine_ls_shift/su_max          0.0010
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^)+(0.0197P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0909
_reflns_number_gt                4707
_reflns_number_total             6203
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            c2dt30997a.txt
_cod_data_source_block           '__complex-3'
_cod_original_cell_volume        5450.4(19)
_cod_original_formula_sum        'C47 H52 F12 N10 O2 P2 Pt2 S2 '
_cod_database_code               7030216