Influence of Ring-Expanded N-Heterocyclic Carbenes on the Structures of Half-Sandwich Ni(I) Complexes: An X-ray, Electron Paramagnetic Resonance (EPR), and Electron Nuclear Double Resonance (ENDOR) Study.
Pelties, Stefan; Carter, Emma; Folli, Andrea; Mahon, Mary F.; Murphy, Damien M.; Whittlesey, Michael K.; Wolf, Robert; Inorganic chemistry 55 (2016) 11006–11017; doi:10.1021/acs.inorgchem.6b01540

data_4348701
_publ_section_title
;
 Influence of Ring-Expanded N-Heterocyclic Carbenes on the Structures of
 Half-Sandwich Ni(I) Complexes: An X-ray, Electron Paramagnetic Resonance
 (EPR), and Electron Nuclear Double Resonance (ENDOR) Study.
;
_journal_issue                   21
_journal_name_full               'Inorganic chemistry'
_journal_page_first              11006
_journal_page_last               11017
_journal_paper_doi               10.1021/acs.inorgchem.6b01540
_journal_volume                  55
_journal_year                    2016
_chemical_formula_moiety         'C29 H33 Br N2 Ni O2, 0.5(C7 H8)'
_chemical_formula_sum            'C32.5 H37 Br N2 Ni O2'
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_space_group_name_Hall           '-I 2ya'
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CrysAlisPro, Agilent Technologies,
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CrysAlisPro, Agilent Technologies,
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CrysAlisPro, Agilent Technologies,
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Numerical absorption correction based on gaussian integration over
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'w=1/[\s^2^(Fo^2^)+(0.0391P)^2^+7.3213P] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            ic6b01540_si_001.cif
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_cod_original_cell_volume        5887.03(15)
_cod_original_formula_sum        'C32.50 H37 Br N2 Ni O2'
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