Two <i>fac</i>-tricarbonylrhenium(I) azadipyrromethene (ADPM) complexes: ligand-substitution effect on crystal structure
Cibian, Mihaela; Bessette, André; O'Connor, Andrew; Ferreira, Janaina G.; Hanan, Garry S.; Acta Crystallographica Section C 71 (2015) –; doi:10.1107/S2053229614027673

data_2019791
_publ_section_title
;
 Two <i>fac</i>-tricarbonylrhenium(I) azadipyrromethene (ADPM) complexes:
 ligand-substitution effect on crystal structure
;
_journal_coeditor_code           OV3057
_journal_issue                   2
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first
;
;
_journal_paper_doi               10.1107/S2053229614027673
_journal_volume                  71
_journal_year                    2015
_chemical_formula_iupac
'[Re (C36 H30 N3 O4) (C2 H3 N) (C O)3], 0.5C6 H14, C2 H3 N'
_chemical_formula_moiety         'C41 H33 N4 O7 Re, 0.5(C6 H14), C2 H3 N'
_chemical_formula_sum            'C46 H43 N5 O7 Re'
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_chemical_name_systematic
;
<i>fac</i>-(Acetonitrile-\k<i>N</i>)(2-{[3,5-bis(4-methoxyphenyl)-2<i>H</i>-\
pyrrol-2-ylidene-\k<i>N</i>^1^]amino}-\
3,5-bis(4-methoxyphenyl)-1<i>H</i>-pyrrol-1-ido-\
\k<i>N</i>^1^)tricarbonylrhenium(I)--hexane--acetonitrile (2/1/2)
;
_space_group_crystal_system      monoclinic
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_space_group_name_Hall           '-P 2yn'
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_symmetry_space_group_name_Hall  '-P 2yn'
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Olex2 1.2
(compiled 2014.11.28 svn.r3106 for OlexSys, GUI svn.r4959)
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SAINT (Bruker, 2007)
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APEX2 (Bruker, 2007)
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SAINT (Bruker, 2007)
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OLEX2 (Dolomanov <i>et al.</i>,  2009) and ORTEP-3 for Windows
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SHELXL2014 (Sheldrick, 2008)
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SHELXS97 (Sheldrick, 2008)
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(SADABS; Bruker, 2001)
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0559P)^2^+8.6779P] where P=(Fo^2^+2Fc^2^)/3'
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