Syntheses, Crystal Structures, and Magnetic Properties of the Oxalato-Bridged Mixed-Valence Complexes [FeII(bpm)3]2[FeIII2(ox)5].8H2O and FeII(bpm)3Na(H2O)2Fe(ox)3.4H2O (bpm = 2,2'-Bipyrimidine)
Donatella Armentano; Giovanni De Munno; Juan Faus; Francesc Lloret; Miguel Julve; Inorganic Chemistry 40 (2001) 655–660; doi:10.1021/ic000258q

data_4319222
_publ_contact_author
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     Prof. G. De Munno
     Dipartimento di Chimica
     Universit\'a della Calabria
     I-87030 Arcavacata di Rende, Cosenza
     Italy
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_publ_contact_author_email       demunno@unical.it
_publ_contact_author_fax         '39 984 492044'
_publ_contact_author_phone       '39 984 492068'
_publ_section_title
;
 Syntheses, Crystal Structures, and Magnetic Properties of the
 Oxalato-Bridged Mixed-Valence Complexes [FeII(bpm)3]2[FeIII2(ox)5].8H2O
 and FeII(bpm)3Na(H2O)2Fe(ox)3.4H2O (bpm = 2,2'-Bipyrimidine)
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              655
_journal_page_last               660
_journal_paper_doi               10.1021/ic000258q
_journal_volume                  40
_journal_year                    2001
_chemical_compound_source        'chemical synthesis'
_chemical_formula_moiety         '[FeII(bpm)3]2[FeIII2(ox)5] . 8H2O'
_chemical_formula_sum            'C58 H52 Fe4 N24 O28'
_chemical_formula_weight         1756.6
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
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_cell_length_b                   13.073(3)
_cell_length_c                   13.308(3)
_cell_measurement_radiation      'Mo K\a'
_cell_measurement_temperature    295
_cell_measurement_wavelength     0.710730
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_computing_cell_refinement       'Bruker P3/V'
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_refine_ls_weighting_details     'w = 1/(\s^2^(F)+ 0.0011*F^2^))'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         7.43
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_reflns_number_observed          4514
_reflns_number_total             7494
_reflns_observed_criterion       >3\s(I)
_cod_data_source_file            ic000258q_1.cif
_cod_data_source_block           (1)
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value '1/(\s^2^(F)+ 0.0011*F^2^))' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to 'w = 1/(\s^2^(F)+
0.0011*F^2^))'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        1707.2(6)
_cod_database_code               4319222