A Tertiary Carbon–Iron Bond as an FeICl Synthon and the Reductive Alkylation of Diphosphine-Supported Iron(II) Chloride Complexes to Low-Valent Iron
Tondreau, Aaron M.; Scott, Brian L.; Boncella, James M.; Organometallics 35 (2016) 1643–; doi:10.1021/acs.organomet.6b00108

data_4088450
_publ_section_title
;
 A Tertiary Carbon--Iron Bond as an FeICl Synthon and the Reductive
 Alkylation of Diphosphine-Supported Iron(II) Chloride Complexes to
 Low-Valent Iron
;
_journal_issue                   11
_journal_name_full               Organometallics
_journal_page_first              1643
_journal_paper_doi               10.1021/acs.organomet.6b00108
_journal_volume                  35
_journal_year                    2016
_chemical_formula_sum            'C54 H48 Fe N2 O0.5 P4'
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_cell_measurement_reflns_used    2958
_cell_measurement_temperature    100(1)
_cell_measurement_theta_max      22.49
_cell_measurement_theta_min      2.23
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_computing_cell_refinement       'APEX2 V.2014.7-1 (Bruker AXS, 2014)'
_computing_data_collection       'APEX2 V.2014.7-1 (Bruker AXS, 2014)'
_computing_data_reduction        'SAINT, v. 8.34A (Bruker AXS, 2013)'
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_diffrn_radiation_source         'fine-focus sealed tube'
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_diffrn_standards_interval_time  0
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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^)+(0.0530P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            om6b00108_si_002.cif
_cod_data_source_block           apx2053
_cod_original_cell_volume        8729(2)
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_original_formula_sum        'C54 H48 Fe N2 O0.50 P4'
_cod_database_code               4088450
_shelx_shelxl_version_number     2014/7
_shelx_estimated_absorpt_t_min   0.815
_shelx_estimated_absorpt_t_max   0.901
_shelx_res_checksum              88926
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