Janus-Type Bis(maloNHC) and Its Zwitterionic Gold and Silver Metal Complexes
Carter, Ashley; Mason, Alexander; Baker, Michael A.; Bettler, Donald G.; Changas, Angelo; McMillen, Colin D.; Tapu, Daniela; Organometallics 36 (2017) 1867–; doi:10.1021/acs.organomet.7b00206

data_4087254
_publ_section_title
;
 Janus-Type Bis(maloNHC) and Its Zwitterionic Gold and Silver Metal
 Complexes
;
_journal_issue                   9
_journal_name_full               Organometallics
_journal_page_first              1867
_journal_paper_doi               10.1021/acs.organomet.7b00206
_journal_volume                  36
_journal_year                    2017
_chemical_formula_sum            'C95 H106 N4 O4'
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_space_group_name_H-M_alt        'P 1 21/n 1'
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_symmetry_space_group_name_H-M   'P 1 21/n 1'
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_cell_angle_gamma                90
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_cell_measurement_temperature    100(2)
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_cell_volume                     8672.2(10)
_computing_cell_refinement       'Bruker SAINT'
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_computing_structure_solution    'SHELXT-2014 (Sheldrick 2014)'
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_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker D8 Venture Photon 100'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_limit_h_max       23
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_diffrn_reflns_theta_min         2.096
_diffrn_source                   'Incoatec I\mS'
_exptl_absorpt_coefficient_mu    0.063
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.8658
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_exptl_absorpt_process_details   'SADABS, Bruker'
_exptl_crystal_colour            yellow
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_refine_ls_R_factor_all          0.0794
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0962P)^2^+9.0880P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_total             16123
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            om7b00206_si_002.cif
_cod_data_source_block           6
_cod_depositor_comments
'Adding full bibliography for 4087254--4087257.cif.'
_cod_database_code               4087254
_shelx_shelxl_version_number     2014/7
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_shelx_hkl_checksum              19083
_shelx_fab_checksum              56989