Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic Dicopper(I) Center and Mixed-Valence μ-Aryl Dicopper(I,II) Complexes.
Ziegler, Micah S.; Levine, Daniel S.; Lakshmi, K. V.; Tilley, T. Don; Journal of the American Chemical Society 138 (2016) 6484–6491; doi:10.1021/jacs.6b00802

data_4130143
_publ_section_title
;
 Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic
 Dicopper(I) Center and Mixed-Valence \m-Aryl Dicopper(I,II) Complexes.
;
_journal_issue                   20
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              6484
_journal_page_last               6491
_journal_paper_doi               10.1021/jacs.6b00802
_journal_volume                  138
_journal_year                    2016
_chemical_formula_moiety         'C32 H23 Cu2 F2 N7, 2(F6 P),2.5(C6 H5 N1 O2)'
_chemical_formula_sum            'C47 H35.5 Cu2 F14 N9.5 O5 P2'
_chemical_formula_weight         1268.75
_chemical_name_common            '[Cu2(NCCH3)DPFN](PF6)2,2.5(C6H5NO2)'
_space_group_crystal_system      monoclinic
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_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
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_diffrn_ambient_temperature      100(2)
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_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_point_group_measured_fraction_full 1.000
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_diffrn_reflns_theta_max         25.392
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_diffrn_source                   'microfocus sealed tube'
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_refine_ls_extinction_method     none
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_refine_ls_matrix_type           full
_refine_ls_number_parameters     911
_refine_ls_number_reflns         9180
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0471P)^2^+7.6023P] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_number_total             9180
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            ja6b00802_si_002.cif
_cod_data_source_block           shelx1
_cod_original_sg_symbol_H-M      'P 21/n'
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_shelx_estimated_absorpt_t_min   0.913
_shelx_estimated_absorpt_t_max   0.990
_shelx_res_checksum              76859
_shelx_hkl_checksum              61895