Ruthenium-mediated nucleophilic aromatic substitution of hydrogen in benzene.
Melnikov, Stanislav; Hwang, Donghun; Gabbert, Philip; Park, Bohyun; Lutz, Martin; Baik, Mu-Hyun; Broere, Daniël L J; Chemical science 16 (2025) 13422–13434; doi:10.1039/d5sc02090e

data_1574949
_publ_section_title
;
 Ruthenium-mediated nucleophilic aromatic substitution of hydrogen in
 benzene.
;
_journal_issue                   29
_journal_name_full               'Chemical science'
_journal_page_first              13422
_journal_page_last               13434
_journal_paper_doi               10.1039/d5sc02090e
_journal_volume                  16
_journal_year                    2025
_chemical_formula_moiety         'C28 H48 Cl2 N2 P2 Ru'
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_audit_update_record
;
2024-05-16 deposited with the CCDC.	2025-06-23 downloaded from the CCDC.
;
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_diffrn_reflns_point_group_measured_fraction_full 1.000
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_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
 SADABS 2016/2: Krause, L., Herbst-Irmer, R., Sheldrick G.M. & Stalke D.,
 J. Appl. Cryst. 48 (2015) 3-10
;
_exptl_crystal_colour            orange
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0271P)^2^+1.5507P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                15032
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d5sc02090e3.cif
_cod_data_source_block           l1291a
_cod_depositor_comments
'Adding full bibliography for 1574948--1574950.cif.'
_cod_original_cell_volume        6181.8(2)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               1574949
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