A monodentate 1,3-diphenyl-2-triazeno terpyridineplatinum(II) complex
Bailey, J. A.; Catalano, V. J.; Gray, H. B.; Acta Crystallographica Section C 49 (1993) 1598–1602; doi:10.1107/S0108270193002215

data_2001372
_publ_section_title
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 A monodentate 1,3-diphenyl-2-triazeno terpyridineplatinum(II) complex
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_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              1598
_journal_page_last               1602
_journal_paper_doi               10.1107/S0108270193002215
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         ' 2(C27 H21 N6 Pt1),2(Cl1 O4),2(C3 H7 N1 O1)'
_chemical_formula_sum            'C60 H56 Cl2 N14 O10 Pt2'
_chemical_formula_weight         1594.30
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_type_scat_source           'Cromer (1974);Cromer & Waber (1974)'
_cell_angle_alpha                90.
_cell_angle_beta                 92.34(2)
_cell_angle_gamma                90.
_cell_formula_units_Z            4
_cell_length_a                   15.610(4)
_cell_length_b                   14.809(5)
_cell_length_c                   25.918(9)
_cell_measurement_reflns_used    24
_cell_measurement_temperature    130
_cell_measurement_theta_max      12.42
_cell_measurement_theta_min      6.35
_cell_volume                     5986(3)
_diffrn_measurement_device       'Nicolet R3m/V'
_diffrn_measurement_method       '\w scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_limit_h_max       18
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            10552
_diffrn_reflns_theta_max         25
_diffrn_standards_decay_%        .0
_diffrn_standards_interval_count 198
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    4.830
_exptl_absorpt_correction_T_max  0.833
_exptl_absorpt_correction_T_min  0.806
_exptl_absorpt_correction_type   refdelf
_exptl_crystal_colour            Red/brown
_exptl_crystal_density_diffrn    1.77
_exptl_crystal_description       Rods
_refine_diff_density_max         1.63
_refine_diff_density_min         -1.19
_refine_ls_goodness_of_fit_obs   1.09
_refine_ls_hydrogen_treatment    'see below'
_refine_ls_number_parameters     476
_refine_ls_number_reflns         6961
_refine_ls_R_factor_obs          0.056
_refine_ls_shift/esd_max         '0.11 for C(33); 0.02 for all others'
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[\s^2^(F)+0.0004F^2^]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_obs         0.058
_reflns_number_observed          6961
_reflns_number_total             10552
_reflns_observed_criterion       F>4\s(F)
_cod_data_source_file            hh1046.cif
_cod_data_source_block           hh1046_structure_1_of_1
_cod_depositor_comments
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The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value '1/[\s^2^(F)+0.0004F^2^]' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to 'w =
1/[\s^2^(F)+0.0004F^2^]'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
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_cod_database_code               2001372