;   () –; doi:10.1107/S2056989024010788

data_1573344
_journal_coeditor_code           YZ2060
_journal_paper_doi               10.1107/S2056989024010788
_chemical_formula_iupac          '[Au (C10 H23 P1 S1)2] [Au I2]0.125 (I3)0.875'
_chemical_formula_moiety
'C20 H46 Au P2 S2 +, 0.875(I3 -), 0.125(Au I2 -)'
_chemical_formula_sum            'C20 H46 Au1.125 I2.875 P2 S2'
_chemical_formula_weight         999.05
_chemical_name_systematic
;
Bis(<i>tert</i>-butyldiisopropylphosphine sulfide-\k<i>S</i>)gold(I)
triiodide/diiodidoaurate(I)(0.875/0.125)
;
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2019/3
_cell_angle_alpha                90
_cell_angle_beta                 90.090(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   11.6180(2)
_cell_length_b                   11.8894(3)
_cell_length_c                   22.5768(5)
_cell_measurement_reflns_used    25881
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      29.3330
_cell_measurement_theta_min      2.4430
_cell_volume                     3118.55(12)
_computing_cell_refinement
;
CrysAlisPro, Version 1.171.36.28 (Rigaku OD, 2015)
;
_computing_data_collection
;
CrysAlisPro, Version 1.171.36.28 (Rigaku OD, 2015)
;
_computing_data_reduction
;
CrysAlisPro, Version 1.171.36.28 (Rigaku OD, 2015)
;
_computing_molecular_graphics
;
Bruker XP, Version 5.1 (Bruker, 1998)
;
_computing_publication_material
;
<i>SHELXL2019/3</i> (Sheldrick, 2015)
;
_computing_structure_refinement
;
<i>SHELXL2019/3</i> (Sheldrick, 2015)
;
_computing_structure_solution
;
SHELXS-97 (Sheldrick, 2008)
;
_diffrn_ambient_temperature      100(2)
_diffrn_detector_area_resol_mean 16.1419
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Oxford Diffraction Xcalibur, Eos'
_diffrn_measurement_method       '\w scan'
_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  0.0717
_diffrn_reflns_av_unetI/netI     0.0265
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_l_max       30
_diffrn_reflns_limit_l_min       -30
_diffrn_reflns_number            142434
_diffrn_reflns_theta_full        28.000
_diffrn_reflns_theta_max         28.281
_diffrn_reflns_theta_min         2.451
_exptl_absorpt_coefficient_mu    8.392
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.56497
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(CrysAlisPro; Rigaku OD, 2015)
;
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    2.128
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             1877
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.08
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.650
_refine_diff_density_min         -0.792
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.080
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     281
_refine_ls_number_reflns         7725
_refine_ls_number_restraints     7
_refine_ls_restrained_S_all      1.081
_refine_ls_R_factor_all          0.0257
_refine_ls_R_factor_gt           0.0219
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0120P)^2^+2.6204P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0398
_refine_ls_wR_factor_ref         0.0411
_reflns_number_gt                7218
_reflns_number_total             7725
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            yz2060.cif
_cod_data_source_block           3
_cod_original_cell_volume        3118.54(12)
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               1573344
_shelx_estimated_absorpt_t_min   0.366
_shelx_estimated_absorpt_t_max   0.679
_shelx_hkl_checksum              62060
_shelx_res_checksum              66551