Dinuclear cobalt(iii) and mixed valence trinuclear MnIII–MnII–MnIIIcomplexes with a tripodal bridging pyridylaminophenol ligand
Davila, Ruben; Farias, Nicolas; Carolina Sañudo, E.; Vega, Andrés; Escuer, Albert; Soler, Mónica; Manzur, Jorge; New J. Chem. 40 (2016) 6164–; doi:10.1039/C5NJ03670D

data_7055543
_publ_section_title
;
 Dinuclear cobalt(iii) and mixed valence trinuclear
 MnIII--MnII--MnIIIcomplexes with a tripodal bridging pyridylaminophenol
 ligand
;
_journal_issue                   7
_journal_name_full               'New J. Chem.'
_journal_page_first              6164
_journal_paper_doi               10.1039/C5NJ03670D
_journal_volume                  40
_journal_year                    2016
_chemical_formula_moiety         'C45 H45 Co2 N4 O6, Cl O4, C4 H10 O'
_chemical_formula_sum            'C49 H55 Cl Co2 N4 O11'
_chemical_formula_weight         1029.28
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2016-04-08 deposited with the CCDC.
2016-05-06 downloaded from the CCDC.
;
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_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.980
_diffrn_measured_fraction_theta_max 0.944
_diffrn_measurement_device_type  'Bruker Smart APEX II'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'Mo microsource'
_diffrn_radiation_type           MoK\a
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_exptl_absorpt_correction_T_min  0.819
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_refine_ls_R_factor_gt           0.0534
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0907P)^2^+0.5400P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1394
_refine_ls_wR_factor_ref         0.1754
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_reflns_number_gt                8349
_reflns_number_total             12000
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c5nj03670d2.cif
_cod_data_source_block           959RD099_0m
_cod_depositor_comments
'Adding full bibliography for 7055543--7055544.cif.'
_cod_database_code               7055543
_shelx_shelxl_version_number     2014/7
_shelx_estimated_absorpt_t_min   0.819
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_shelx_res_checksum              13010