Nickel-Catalyzed Annulations of ortho-Haloarylimines
Kolluru, Srinivas; Singh, Manvendra; Gaskins, Bryce; Boskovic, Zarko; ACS Catalysis 11 (2021) 10351–10361; doi:10.1021/acscatal.1c03092

data_4518996
_publ_section_title
;
 Nickel-Catalyzed Annulations of ortho-Haloarylimines
;
_journal_issue                   16
_journal_name_full               'ACS Catalysis'
_journal_page_first              10351
_journal_page_last               10361
_journal_paper_doi               10.1021/acscatal.1c03092
_journal_volume                  11
_journal_year                    2021
_chemical_formula_sum            'C20 H20 Br2 N2 Ni'
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_audit_update_record
;
2020-09-21 deposited with the CCDC.	2021-05-31 downloaded from the CCDC.
;
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_exptl_crystal_description       Parallelepiped
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_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0657P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1012
_refine_ls_wR_factor_ref         0.1063
_reflns_Friedel_coverage         0.000
_reflns_number_gt                2904
_reflns_number_total             3553
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            cs1c03092_si_005.cif
_cod_data_source_block           q78k
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value 'Multi-Scan' was
changed to 'multi-scan' in accordance with the
/home/data/users/saulius/crontab/automatic-downloads/current/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 7556 2019-12-06 15:28:31Z antanas 
;
_cod_original_cell_volume        1976.41(8)
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4518996
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_shelx_estimated_absorpt_t_max   0.941
_shelx_res_checksum              46698
_shelx_hkl_checksum              69886