Anti-Markovnikov Hydroheteroarylation of Unactivated Alkenes with Indoles, Pyrroles, Benzofurans, and Furans Catalyzed by a Nickel-N-Heterocyclic Carbene System.
Schramm, York; Takeuchi, Makoto; Semba, Kazuhiko; Nakao, Yoshiaki; Hartwig, John F.; Journal of the American Chemical Society 137 (2015) 12215–12218; doi:10.1021/jacs.5b08039

data_4124567
_publ_section_title
;
 Anti-Markovnikov Hydroheteroarylation of Unactivated Alkenes with
 Indoles, Pyrroles, Benzofurans, and Furans Catalyzed by a
 Nickel-N-Heterocyclic Carbene System.
;
_journal_issue                   38
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              12215
_journal_page_last               12218
_journal_paper_doi               10.1021/jacs.5b08039
_journal_volume                  137
_journal_year                    2015
_chemical_formula_sum            'C75 H62 N2 Ni O2'
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_chemical_name_common            YS-(IPr*OMe)Ni(C6H6)
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_diffrn_measurement_device_type  'Bruker APEX-II CCD'
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_diffrn_source                   'microfocus sealed tube'
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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^)+(0.0538P)^2^+1.9207P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1120
_refine_ls_wR_factor_ref         0.1456
_reflns_Friedel_coverage         0.000
_reflns_number_gt                5493
_reflns_number_total             10405
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            ja5b08039_si_003.cif
_cod_data_source_block           hartwig83
_cod_depositor_comments
;
The following automatic conversions were performed:

'_space_group.centring_type' value 'primitive' was replaced with the
value 'P' as specified in the replacement file
'/home/antanas/src/cod-tools/trunk/data/replacement-values/replacement_values.lst'.

Automatic conversion script
Id: cif_fix_values 5642 2017-10-24 12:04:52Z antanas 
;
_cod_database_code               4124567
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