meso-N-Methylation of a porphyrinoid complex: activating the H-atom transfer capability of an inert Re(V)(O) corrolazine.
Joslin, Evan E.; Zaragoza, Jan Paulo T.; Siegler, Maxime A.; Goldberg, David P.; Chemical communications (Cambridge, England) 53 (2017) 1961–1964; doi:10.1039/c6cc09341h

data_7119536
_publ_section_title
;
 meso-N-Methylation of a porphyrinoid complex: activating the H-atom
 transfer capability of an inert Re(V)(O) corrolazine.
;
_journal_issue                   12
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              1961
_journal_page_last               1964
_journal_paper_doi               10.1039/c6cc09341h
_journal_volume                  53
_journal_year                    2017
_chemical_formula_moiety
'C97 H108 N7 O Re, 2(C24 B F20), 1.414(C7 H16)'
_chemical_formula_sum            'C154.9 H130.62 B2 F40 N7 O Re'
_chemical_formula_weight         3073.83
_space_group_crystal_system      triclinic
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_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
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;
2016-10-19 deposited with the CCDC.
2017-01-03 downloaded from the CCDC.
;
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
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CrysAlisPro, Agilent Technologies,
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
(compiled Aug  2 2013,16:46:58)
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CrysAlisPro, Agilent Technologies,
Version 1.171.36.32 (release 02-08-2013 CrysAlis171 .NET)
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Analytical numeric absorption correction using a multifaceted crystal
            model based on expressions derived by R.C. Clark & J.S. Reid.
(Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897)
;
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    1.375
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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^)+(0.0520P)^2^+5.6353P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0938
_refine_ls_wR_factor_ref         0.0984
_reflns_Friedel_coverage         0.000
_reflns_number_gt                26868
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c6cc09341h2.cif
_cod_data_source_block           2
_cod_depositor_comments          'Adding full bibliography for 7119536.cif.'
_cod_original_cell_volume        7424.19(13)
_cod_original_formula_sum        'C154.90 H130.62 B2 F40 N7 O Re'
_cod_database_code               7119536
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