Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel Complex via Metal-Metal Cooperative Oxidative Addition.
Stevens, Hendrik; Duan, Peng-Cheng; Dechert, Sebastian; Meyer, Franc; Journal of the American Chemical Society  (2020) –; doi:10.1021/jacs.0c00758

data_4134544
_publ_section_title
;
 Competing H2 versus Intramolecular C-H Activation at a Dinuclear Nickel
 Complex via Metal-Metal Cooperative Oxidative Addition.
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/jacs.0c00758
_journal_year                    2020
_chemical_formula_moiety         'C51 H45 K N6 Ni2'
_chemical_formula_sum            'C51 H45 K N6 Ni2'
_chemical_formula_weight         898.45
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_cell_length_c                   17.0678(10)
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_cell_measurement_temperature    133(2)
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_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Stoe IPDS II'
_diffrn_measurement_method       \w
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_av_unetI/netI     0.0965
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_diffrn_reflns_Laue_measured_fraction_max 0.994
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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^)+(0.0404P)^2^] where P=(Fo^2^+2Fc^2^)/3'
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_cod_data_source_block           2K-pd82-2
_cod_original_sg_symbol_H-M      'P 21/n'
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_shelx_estimated_absorpt_t_min   0.793
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_shelx_hkl_checksum              43773