Geometric and electronic structure of a peroxomanganese(iii) complex supported by a scorpionate ligand.
Colmer, Hannah E.; Geiger, Robert A.; Leto, Domenick F.; Wijeratne, Gayan B.; Day, Victor W.; Jackson, Timothy A.; Dalton transactions (Cambridge, England : 2003) 43 (2014) 17949–17963; doi:10.1039/c4dt02483d

data_7032711
_publ_section_title
;
 Geometric and electronic structure of a peroxomanganese(iii) complex
 supported by a scorpionate ligand.
;
_journal_issue                   48
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              17949
_journal_page_last               17963
_journal_paper_doi               10.1039/c4dt02483d
_journal_volume                  43
_journal_year                    2014
_chemical_formula_sum            'C59 H63 B F3 Mn N9 O7 S'
_chemical_formula_weight         1164.99
_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'
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_atom_sites_solution_hydrogens   mixed
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_diffrn_measured_fraction_theta_max 0.958
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
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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^)+(0.0602P)^2^+3.2180P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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'Adding full bibliography for 7032711--7032712.cif.'
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