Synthesis and luminescence behaviour of mixed-metal rhenium(I)‒copper(I) and ‒silver(I) alkynyl complexes. X-Ray crystal structures of [{η2-Re(CO)3(bpy)(CCPh)}2Cu]PF6 and [{η2-Re(CO)3(bpy)(CCPh)}2Ag]PF6
Yam, Vivian Wing-Wah; Chong, Samuel Hung-Fai; Wong, Keith Man-Chung; Cheung, Kung-Kai; Chemical Communications  (1999) 1013–; doi:10.1039/a902273b

data_7110539
_publ_contact_author
;
    ENTER NAME
 ENTER ADDRESS
;
_publ_section_title
;
 Synthesis and luminescence behaviour of mixed-metal rhenium(I)--copper(I)
 and --silver(I) alkynyl complexes. X-Ray crystal structures of
 [{\h2-Re(CO)3(bpy)(C&#xE007;CPh)}2Cu]PF6 and
 [{\h2-Re(CO)3(bpy)(C&#xE007;CPh)}2Ag]PF6
;
_journal_issue                   11
_journal_name_full               'Chemical Communications'
_journal_page_first              1013
_journal_paper_doi               10.1039/a902273b
_journal_year                    1999
_chemical_formula_sum            'C43 H28 Cl2 Cu F6 N4 O6 P Re2'
_chemical_formula_weight         1348.55
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_audit_creation_date             'Tue Feb 23 17:28:33 1999'
_audit_creation_method           'from TEXRAY.INF file'
_cell_angle_alpha                81.432(7)
_cell_angle_beta                 82.688(7)
_cell_angle_gamma                88.139(7)
_cell_formula_units_Z            4
_cell_length_a                   10.806(1)
_cell_length_b                   17.408(2)
_cell_length_c                   25.199(2)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    301.2
_cell_measurement_theta_max      33.4
_cell_measurement_theta_min      30.1
_cell_volume                     4648.7(8)
_computing_cell_refinement       'MSC/AFC Diffractometer Control'
_computing_data_collection       'MSC/AFC Diffractometer Control'
_computing_data_reduction        teXsan
_computing_publication_material  teXsan
_computing_structure_refinement  teXsan
_computing_structure_solution    'DIRDIF92 (PATTY)'
_diffrn_ambient_temperature      301.2
_diffrn_measurement_device       AFC7R
_diffrn_measurement_method       'omega scans with profile analysis'
_diffrn_orient_matrix_UB_11      0.00552
_diffrn_orient_matrix_UB_12      -0.04536
_diffrn_orient_matrix_UB_13      -0.02036
_diffrn_orient_matrix_UB_21      -0.01112
_diffrn_orient_matrix_UB_22      -0.03622
_diffrn_orient_matrix_UB_23      0.03495
_diffrn_orient_matrix_UB_31      0.09248
_diffrn_orient_matrix_UB_32      -0.00246
_diffrn_orient_matrix_UB_33      0.00036
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'X-ray tube'
_diffrn_radiation_type           MoKalpha
_diffrn_radiation_wavelength     0.7107
_diffrn_reflns_av_R_equivalents  0.0205
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            16929
_diffrn_reflns_theta_max         25.00
_diffrn_standards_decay_%        -3.53
_diffrn_standards_interval_count 300
_diffrn_standards_number         3
_exptl_absorpt_coefficient_mu    5.874
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_correction_T_min  0.770
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   psi-scan
_exptl_crystal_colour            colourlessprism
_exptl_crystal_density_diffrn    1.927
_exptl_crystal_density_meas      0.000
_exptl_crystal_description       prism
_exptl_crystal_F_000             2576.00
_exptl_crystal_size_max          0.300
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.070
_refine_diff_density_max         1.49
_refine_diff_density_min         -0.84
_refine_ls_extinction_coef       0.22290
_refine_ls_extinction_method     Zachariasen_type_2_Gaussian_isotropic
_refine_ls_goodness_of_fit_obs   1.456
_refine_ls_hydrogen_treatment    noref
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1111
_refine_ls_number_reflns         10761
_refine_ls_number_restraints     0
_refine_ls_R_factor_obs          0.0324
_refine_ls_shift/esd_max         1.5530
_refine_ls_structure_factor_coef F
_refine_ls_weighting_scheme      sigma
_refine_ls_wR_factor_obs         0.0448
_reflns_number_observed          10761
_reflns_number_total             16342
_reflns_observed_criterion       3.00
_cod_data_source_file            902273bsup1.cif
_cod_data_source_block           1
_cod_original_cell_volume        4648(1)
_cod_original_sg_symbol_H-M      'P -1       '
_cod_original_formula_sum        'C43 H28 Cl2 Cu F6 N4 O6 P Re2 '
_cod_database_code               7110539