Gold(I) Hydride Intermediate in Catalysis: Dehydrogenative Alcohol Silylation Catalyzed by Gold(I) Complex
Ito, Hajime; Saito, Tomohisa; Miyahara, Takahiro; Zhong, Chongmin; Sawamura, Masaya; Organometallics 28 (2009) 4829–; doi:10.1021/om900445w

data_4083449
_publ_section_title
;
 Gold(I) Hydride Intermediate in Catalysis: Dehydrogenative Alcohol
 Silylation Catalyzed by Gold(I) Complex
;
_journal_issue                   16
_journal_name_full               Organometallics
_journal_page_first              4829
_journal_paper_doi               10.1021/om900445w
_journal_volume                  28
_journal_year                    2009
_chemical_formula_sum            'C48 H41 Au Cl O P2'
_chemical_formula_weight         928.22
_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(4)
_cell_angle_beta                 105.8311(4)
_cell_angle_gamma                90.0000(4)
_cell_formula_units_Z            4
_cell_length_a                   12.819(2)
_cell_length_b                   18.468(2)
_cell_length_c                   17.497(2)
_cell_measurement_reflns_used    11393
_cell_measurement_temperature    153.1
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      3.2
_cell_volume                     3985.1(9)
_computing_cell_refinement       CRYSTALCLEAR
_computing_data_collection       CRYSTALCLEAR
_computing_data_reduction        'teXsan Ver. 1.11'
_computing_publication_material  'teXsan Ver. 1.11'
_computing_structure_refinement  'teXsan Ver. 1.10'
_computing_structure_solution    SIR92
_diffrn_detector_area_resol_mean 14.71
_diffrn_measured_fraction_theta_full 0.9961
_diffrn_measured_fraction_theta_max 0.9961
_diffrn_measurement_device_type  'Rigaku/MSC Mercury CCD'
_diffrn_measurement_method       \w
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.023
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       23
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -19
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_diffrn_reflns_theta_full        27.49
_diffrn_reflns_theta_max         27.49
_exptl_absorpt_coefficient_mu    3.888
_exptl_absorpt_correction_T_max  0.678
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.547
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_size_max          0.200
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.100
_refine_diff_density_max         2.71
_refine_diff_density_min         -0.67
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.800
_refine_ls_hydrogen_treatment    noref
_refine_ls_number_parameters     478
_refine_ls_number_reflns         7736
_refine_ls_R_factor_gt           0.0263
_refine_ls_shift/su_max          0.0498
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[\s^2^(Fo) + 0.00063|Fo|^2^]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0342
_reflns_number_gt                7288
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_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            1a.cif
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_cod_original_cell_volume        3985.5(9)
_cod_original_formula_sum        'C48 H41 Au Cl O P2 '
_cod_database_code               4083449