Cleavage of cluster iron-sulfide bonds in cyclophane-coordinated Fe<sub>n</sub>S<sub>m</sub> complexes.
Buratto, William R.; Ferreira, Ricardo B.; Catalano, Vincent J.; García-Serres, Ricardo; Murray, Leslie J.; Dalton transactions (Cambridge, England : 2003) 50 (2021) 816–821; doi:10.1039/d0dt03805a

data_7706315
_publ_section_title
;
 Cleavage of cluster iron-sulfide bonds in cyclophane-coordinated
 Fe<sub>n</sub>S<sub>m</sub> complexes.
;
_journal_issue                   3
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              816
_journal_page_last               821
_journal_paper_doi               10.1039/d0dt03805a
_journal_volume                  50
_journal_year                    2021
_chemical_formula_sum            'C51 H78 Fe2 N6 S2'
_chemical_formula_weight         951.01
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_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2016/6
_audit_update_record
;
2020-08-31 deposited with the CCDC.	2020-12-21 downloaded from the CCDC.
;
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_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       '\f and \w scans'
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_exptl_crystal_size_mid          0.210
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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^)+(0.0612P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1056
_refine_ls_wR_factor_ref         0.1093
_reflns_Friedel_coverage         0.000
_reflns_number_gt                11924
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d0dt03805a2.cif
_cod_data_source_block           rf881_0m
_cod_depositor_comments          'Adding full bibliography for 7706315.cif.'
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