Fe(III) Bipyrrolidine Phenoxide Complexes and Their Oxidized Analogues.
Chiang, Linus; Savard, Didier; Shimazaki, Yuichi; Thomas, Fabrice; Storr, Tim; Inorganic chemistry 53 (2014) 5810–5819; doi:10.1021/ic500663x

data_4338392
_publ_section_title
;
 Fe(III) Bipyrrolidine Phenoxide Complexes and Their Oxidized Analogues.
;
_journal_issue                   11
_journal_name_full               'Inorganic chemistry'
_journal_page_first              5810
_journal_page_last               5819
_journal_paper_doi               10.1021/ic500663x
_journal_volume                  53
_journal_year                    2014
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_chemical_formula_sum            'C38 H58 Cl Fe N2 O2'
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_exptl_absorpt_coefficient_mu    0.510
_exptl_absorpt_correction_type   none
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_exptl_crystal_description       block
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_refine_ls_abs_structure_details 'Flack (1983), 3679 Friedel-pairs'
_refine_ls_abs_structure_Flack   0.071(9)
_refine_ls_extinction_method     None
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_refine_ls_hydrogen_treatment    constr
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;
'w=1/[\s^2^(Fo^2^)+(0.0405P)^2^+4.4315P] where P=(Fo^2^+2Fc^2^)/3'
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1084
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_reflns_limit_h_min              -34
_reflns_limit_k_max              34
_reflns_limit_k_min              -28
_reflns_limit_l_max              15
_reflns_limit_l_min              -15
_reflns_number_gt                6734
_reflns_number_total             7481
_reflns_threshold_expression     I>2.0\s(I)
_cod_data_source_file            ic500663x_si_002.cif
_cod_data_source_block           SSFeL1Cl
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'None' changed to 'none'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 4338391--4338394.cif.
;
_cod_original_cell_volume        8382(16)
_cod_original_formula_sum        'C38 H58 Cl1 Fe1 N2 O2'
_cod_database_code               4338392
_shelx_res_checksum              57299