Two complexes of Pt^IV^ and Au^III^ with 2,2'-dipyridylamine and 2,2'-dipyridylaminide ligands
Chernyshev, Alexander N.; Kukushkin, Vadim Yu.; Haukka, Matti; Acta Crystallographica Section C 70 (2014) –; doi:10.1107/S2053229614021548

data_2019725
_publ_section_title
;
 Two complexes of Pt^IV^ and Au^III^ with 2,2'-dipyridylamine and
 2,2'-dipyridylaminide ligands
;
_journal_coeditor_code           DT3029
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first
;
;
_journal_paper_doi               10.1107/S2053229614021548
_journal_volume                  70
_journal_year                    2014
_chemical_formula_iupac          '[Au Cl2 (C10 H8 N3)]'
_chemical_formula_moiety         'C10 H8 Au Cl2 N3'
_chemical_formula_sum            'C10 H8 Au Cl2 N3'
_chemical_formula_weight         438.06
_chemical_name_systematic
;
[bis(pyridin-2-yl-\k<i>N</i>)aminido]dichloridogold(III)
;
_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
_audit_creation_method           SHELXL2014
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_cell_angle_beta                 98.263(5)
_cell_angle_gamma                105.452(6)
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_cell_length_b                   8.8933(7)
_cell_length_c                   9.5996(8)
_cell_measurement_reflns_used    9134
_cell_measurement_temperature    100(2)
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_cell_measurement_theta_min      3.17
_cell_volume                     542.50(12)
_computing_cell_refinement       'SAINT (Bruker, 2009)'
_computing_data_collection       'APEX2 (Bruker, 2010)'
_computing_data_reduction        'SAINT (Bruker, 2009)'
_computing_molecular_graphics    'OLEX2 (Dolomanov et al., 2009)'
_computing_publication_material  'SHELXL2014 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL2014 (Sheldrick, 2008)'
_computing_structure_solution    'SUPERFLIP (Palatinus & Chapuis, 2007)'
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 16
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device
'62mm x 62mm CCD camera on three-circle goniostat'
_diffrn_measurement_device_type  'Bruker SMART APEXII CCD area-detector'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_monochromator  'flat graphite crystal'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0377
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
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_diffrn_reflns_theta_max         28.280
_diffrn_reflns_theta_min         2.450
_exptl_absorpt_coefficient_mu    14.022
_exptl_absorpt_correction_T_max  0.4774
_exptl_absorpt_correction_T_min  0.1713
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   '(SADABS; Sheldrick, 2008)'
_exptl_crystal_colour            violet
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_exptl_crystal_description       block
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_exptl_crystal_size_mid          0.117
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_refine_ls_extinction_method     none
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_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
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_refine_ls_number_reflns         2678
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.038
_refine_ls_R_factor_all          0.0253
_refine_ls_R_factor_gt           0.0235
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^)+(0.0396P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_refine_ls_wR_factor_ref         0.0601
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_reflns_threshold_expression     I>2\s(I)
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_cod_database_code               2019725
_shelx_estimated_absorpt_t_min   0.145
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_shelx_hkl_checksum              47391
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