Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N,N′,N′′,N′′′}iron(III) chlorobenzene hemisolvate monohydrate

In the title complex, [Fe(C64H64N8O4)Cl]·0.5C6H5Cl·H2O, the equatorial iron–pyrrole N atom distance (Fe—Np) is 2.065 (2) Å and the axial Fe—Cl distance is 2.207 (2)&#819...

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Main Authors: Mondher Dhifet, Mohamed Salah Belkhiria, Jean-Claude Daran, Habib Nasri
Format: Article
Language:English
Published: International Union of Crystallography 2011-04-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536811009299
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author Mondher Dhifet
Mohamed Salah Belkhiria
Jean-Claude Daran
Habib Nasri
author_facet Mondher Dhifet
Mohamed Salah Belkhiria
Jean-Claude Daran
Habib Nasri
author_sort Mondher Dhifet
collection DOAJ
description In the title complex, [Fe(C64H64N8O4)Cl]·0.5C6H5Cl·H2O, the equatorial iron–pyrrole N atom distance (Fe—Np) is 2.065 (2) Å and the axial Fe—Cl distance is 2.207 (2) Å. The iron cation is displaced by 0.420 (4) Å from the 24-atom mean plane of the porphyrin core. The asymmetric unit contains a quarter of an [FeIII(C64H64N8O4)Cl] complex molecule, with a fourfold rotation axis passing through the central metal cation and the Cl ligand, along with disordered molecules of chlorobenzene and water of solvation; the solvent molecules were excluded from the refinement.
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spelling doaj.art-3c4727b0d6e8436ea0ae07cd95c732b62022-12-21T21:03:32ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682011-04-01674m460m46110.1107/S1600536811009299Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N,N′,N′′,N′′′}iron(III) chlorobenzene hemisolvate monohydrateMondher DhifetMohamed Salah BelkhiriaJean-Claude DaranHabib NasriIn the title complex, [Fe(C64H64N8O4)Cl]·0.5C6H5Cl·H2O, the equatorial iron–pyrrole N atom distance (Fe—Np) is 2.065 (2) Å and the axial Fe—Cl distance is 2.207 (2) Å. The iron cation is displaced by 0.420 (4) Å from the 24-atom mean plane of the porphyrin core. The asymmetric unit contains a quarter of an [FeIII(C64H64N8O4)Cl] complex molecule, with a fourfold rotation axis passing through the central metal cation and the Cl ligand, along with disordered molecules of chlorobenzene and water of solvation; the solvent molecules were excluded from the refinement.http://scripts.iucr.org/cgi-bin/paper?S1600536811009299
spellingShingle Mondher Dhifet
Mohamed Salah Belkhiria
Jean-Claude Daran
Habib Nasri
Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N,N′,N′′,N′′′}iron(III) chlorobenzene hemisolvate monohydrate
Acta Crystallographica Section E
title Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N,N′,N′′,N′′′}iron(III) chlorobenzene hemisolvate monohydrate
title_full Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N,N′,N′′,N′′′}iron(III) chlorobenzene hemisolvate monohydrate
title_fullStr Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N,N′,N′′,N′′′}iron(III) chlorobenzene hemisolvate monohydrate
title_full_unstemmed Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N,N′,N′′,N′′′}iron(III) chlorobenzene hemisolvate monohydrate
title_short Chlorido{5,10,15,20-tetrakis[2-(2,2-dimethylpropanamido)phenyl]porphyrinato-κ4N,N′,N′′,N′′′}iron(III) chlorobenzene hemisolvate monohydrate
title_sort chlorido 5 10 15 20 tetrakis 2 2 2 dimethylpropanamido phenyl porphyrinato amp 954 4n n amp 8242 n amp 8242 amp 8242 n amp 8242 amp 8242 amp 8242 iron iii chlorobenzene hemisolvate monohydrate
url http://scripts.iucr.org/cgi-bin/paper?S1600536811009299
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AT mohamedsalahbelkhiria chlorido5101520tetrakis222dimethylpropanamidophenylporphyrinatoamp9544nnamp8242namp8242amp8242namp8242amp8242amp8242ironiiichlorobenzenehemisolvatemonohydrate
AT jeanclaudedaran chlorido5101520tetrakis222dimethylpropanamidophenylporphyrinatoamp9544nnamp8242namp8242amp8242namp8242amp8242amp8242ironiiichlorobenzenehemisolvatemonohydrate
AT habibnasri chlorido5101520tetrakis222dimethylpropanamidophenylporphyrinatoamp9544nnamp8242namp8242amp8242namp8242amp8242amp8242ironiiichlorobenzenehemisolvatemonohydrate