Photoluminescent properties and molecular structures of [NaphAu(PPh3)] and [μ-Naph {Au(PPh3)}2] ClO4 (Naph = 2-naphthyl)
Osawa, Masahisa; Hoshino, Mikio; Hashizume, Daisuke; Dalton Transactions  (2008) 2248–2252; doi:10.1039/b714609d

data_7003236
_publ_section_title
;
 Photoluminescent properties and molecular structures of [NaphAu(PPh3)]
 and [\m-Naph {Au(PPh3)}2] ClO4 (Naph = 2-naphthyl)
;
_journal_issue                   17
_journal_name_full               'Dalton Transactions'
_journal_page_first              2248
_journal_page_last               2252
_journal_paper_doi               10.1039/b714609d
_journal_year                    2008
_chemical_formula_moiety         'C28 H22 Au P '
_chemical_formula_sum            'C28 H22 Au P'
_chemical_formula_weight         586.42
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_Int_Tables_number      14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.0000
_cell_angle_beta                 114.104(4)
_cell_angle_gamma                90.0000
_cell_formula_units_Z            4
_cell_length_a                   16.523(2)
_cell_length_b                   10.0926(15)
_cell_length_c                   14.4157(18)
_cell_measurement_reflns_used    8117
_cell_measurement_temperature    213.1
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.2
_cell_volume                     2194.4(5)
_computing_cell_refinement       PROCESS-AUTO
_computing_data_collection       PROCESS-AUTO
_computing_data_reduction        CrystalStructure
_computing_publication_material  'CrystalStructure 3.8'
_computing_structure_refinement  SHELXL
_computing_structure_solution    SIR2004
_diffrn_detector_area_resol_mean 10.00
_diffrn_measured_fraction_theta_full 0.989
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device_type  'Rigaku RAXIS-IV'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.043
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            16914
_diffrn_reflns_theta_full        27.47
_diffrn_reflns_theta_max         27.47
_exptl_absorpt_coefficient_mu    6.813
_exptl_absorpt_correction_T_max  0.256
_exptl_absorpt_correction_T_min  0.116
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
Higashi, T. (1995). Program for Absorption Correction.
Rigaku Corporation, Tokyo, Japan.
;
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.775
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1136.00
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.30
_exptl_crystal_size_min          0.20
_refine_diff_density_max         1.29
_refine_diff_density_min         -1.51
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.095
_refine_ls_hydrogen_treatment    refall
_refine_ls_number_parameters     272
_refine_ls_number_reflns         4973
_refine_ls_R_factor_gt           0.0281
_refine_ls_shift/su_max          0.0020
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w = 1/[\s^2^(Fo^2^)+(0.0361P)^2^+2.5020P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0721
_reflns_number_gt                4617
_reflns_number_total             4973
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            b714609d.txt
_cod_data_source_block           '_Na23_____________________'
_cod_original_formula_sum        'C28 H22 Au P '
_cod_database_code               7003236