A green approach for A3-coupling reactions: an experimental and theoretical study on NHC silver and gold catalysts
Costabile, Chiara; Mariconda, Annaluisa; Sirignano, Marco; Crispini, Alessandra; Scarpelli, Francesca; Longo, Pasquale; New Journal of Chemistry 45 (2021) 18509–18517; doi:10.1039/D1NJ03444H

data_7060936
_publ_section_title
;
 A green approach for A3-coupling reactions: an experimental and
 theoretical study on NHC silver and gold catalysts
;
_journal_issue                   39
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              18509
_journal_page_last               18517
_journal_paper_doi               10.1039/D1NJ03444H
_journal_volume                  45
_journal_year                    2021
_chemical_formula_sum            'C13 H16 Au Cl N2 O'
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_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2021-05-22 deposited with the CCDC.	2021-08-25 downloaded from the CCDC.
;
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_diffrn_ambient_temperature      296(2)
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_diffrn_measurement_device_type  'Bruker APEX-II CCD'
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_diffrn_radiation_monochromator  graphite
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0161P)^2^+0.8414P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0378
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_reflns_number_total             3192
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d1nj03444h2.cif
_cod_data_source_block           4b
_cod_depositor_comments          'Adding full bibliography for 7060936.cif.'
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               7060936
_shelx_shelxl_version_number     2014/7
_shelx_estimated_absorpt_t_min   0.100
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_shelx_res_checksum              58574