Isolation and characterization of gem-diaurated species having two C-Au σ bonds in gold(i)-activated amidiniumation of alkynes.
Wang, Jiwei; Lv, Shichang; Chen, Haifeng; Shi, Min; Zhang, Jun; Dalton transactions (Cambridge, England : 2003) 45 (2016) 17091–17094; doi:10.1039/c6dt03475f

data_7040792
_publ_section_title
;
 Isolation and characterization of gem-diaurated species having two C-Au
 \s bonds in gold(i)-activated amidiniumation of alkynes.
;
_journal_issue                   43
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              17091
_journal_page_last               17094
_journal_paper_doi               10.1039/c6dt03475f
_journal_volume                  45
_journal_year                    2016
_chemical_formula_sum            'C65 H67 Au2 F3 N2 O5 P2 S'
_chemical_formula_weight         1501.14
_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2013
_audit_update_record
;
2015-12-02 deposited with the CCDC.
2016-10-03 downloaded from the CCDC.
;
_cell_angle_alpha                109.0540(10)
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_cell_angle_gamma                96.8090(10)
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_computing_cell_refinement       'Bruker SAINT'
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_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      203(2)
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_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
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_diffrn_reflns_av_unetI/netI     0.0480
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_diffrn_reflns_limit_k_min       -18
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_diffrn_reflns_limit_l_min       -21
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_diffrn_reflns_point_group_measured_fraction_full 0.980
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_diffrn_reflns_theta_max         26.999
_diffrn_reflns_theta_min         1.395
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_refine_ls_R_factor_gt           0.0388
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
; 
 w=1/[\s^2^(Fo^2^)+(0.0730P)^2^+3.7258P] 
 where P=(Fo^2^+2Fc^2^)/3 
;
_refine_ls_weighting_scheme      calc
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_cod_depositor_comments          'Adding full bibliography for 7040792.cif.'
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