Oxidatively Induced Reductive Elimination: Exploring the Scope and Catalyst Systems with Ir, Rh, and Ru Complexes.
Kim, Jinwoo; Shin, Kwangmin; Jin, Seongho; Kim, Dongwook; Chang, Sukbok; Journal of the American Chemical Society 141 (2019) 4137–4146; doi:10.1021/jacs.9b00364

data_4128529
_publ_section_title
;
 Oxidatively Induced Reductive Elimination: Exploring the Scope and
 Catalyst Systems with Ir, Rh, and Ru Complexes.
;
_journal_issue                   9
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              4137
_journal_page_last               4146
_journal_paper_doi               10.1021/jacs.9b00364
_journal_volume                  141
_journal_year                    2019
_chemical_formula_sum            'C30 H27 F3 Ir N'
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_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Photon 100 CMOS detector'
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_diffrn_source                   'fine-focus sealed tube'
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_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            orange
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_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0182P)^2^+3.4268P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0486
_refine_ls_wR_factor_ref         0.0516
_reflns_Friedel_coverage         0.000
_reflns_number_gt                13020
_reflns_number_total             14674
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            ja9b00364_si_002.cif
_cod_data_source_block           A059_002
_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 6909 2019-04-08 15:41:33Z antanas 
;
_cod_database_code               4128529
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_shelx_res_checksum              34330
_shelx_hkl_checksum              24778