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Crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(III)]
The title compound, [Fe(2)(C(44)H(28)N(4)O)(2)O], was obtained as a by-product during the synthesis of Fe(III) tetraphenylporphyrin perchlorate. It crystallizes as a new polymorphic modification in addition to the orthorhombic form previously reported [Hoffman et al. (1972 ▸). J. Am. Chem. Soc....
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2019
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6658976/ https://www.ncbi.nlm.nih.gov/pubmed/31391997 http://dx.doi.org/10.1107/S2056989019007576 |
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author | Peters, Morten K. Näther, Christian Herges, Rainer |
author_facet | Peters, Morten K. Näther, Christian Herges, Rainer |
author_sort | Peters, Morten K. |
collection | PubMed |
description | The title compound, [Fe(2)(C(44)H(28)N(4)O)(2)O], was obtained as a by-product during the synthesis of Fe(III) tetraphenylporphyrin perchlorate. It crystallizes as a new polymorphic modification in addition to the orthorhombic form previously reported [Hoffman et al. (1972 ▸). J. Am. Chem. Soc. 94, 3620–3626; Swepston & Ibers (1985 ▸) Acta Cryst. C41, 671–673; Kooijmann et al. (2007 ▸). Private Communication (refcode 667666). CCDC, Cambridge, England]. In its crystal structure, the two crystallographically independent Fe(III) cations are coordinated in a square-planar environment by the four N atoms of a tetraphenylporphyrin ligand. The Fe(III)-tetraphenylporphyrine units are linked by a μ(2)-oxido ligand into a dimer with an Fe—O—Fe angle close to linearity. The final coordination sphere for each Fe(III) atom is square-pyramidal with the μ(2)-oxido ligand in the apical position. The crystal under investigation consisted of two domains in a ratio of 0.691 (3): 0.309 (3). |
format | Online Article Text |
id | pubmed-6658976 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2019 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-66589762019-08-07 Crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(III)] Peters, Morten K. Näther, Christian Herges, Rainer Acta Crystallogr E Crystallogr Commun Research Communications The title compound, [Fe(2)(C(44)H(28)N(4)O)(2)O], was obtained as a by-product during the synthesis of Fe(III) tetraphenylporphyrin perchlorate. It crystallizes as a new polymorphic modification in addition to the orthorhombic form previously reported [Hoffman et al. (1972 ▸). J. Am. Chem. Soc. 94, 3620–3626; Swepston & Ibers (1985 ▸) Acta Cryst. C41, 671–673; Kooijmann et al. (2007 ▸). Private Communication (refcode 667666). CCDC, Cambridge, England]. In its crystal structure, the two crystallographically independent Fe(III) cations are coordinated in a square-planar environment by the four N atoms of a tetraphenylporphyrin ligand. The Fe(III)-tetraphenylporphyrine units are linked by a μ(2)-oxido ligand into a dimer with an Fe—O—Fe angle close to linearity. The final coordination sphere for each Fe(III) atom is square-pyramidal with the μ(2)-oxido ligand in the apical position. The crystal under investigation consisted of two domains in a ratio of 0.691 (3): 0.309 (3). International Union of Crystallography 2019-05-31 /pmc/articles/PMC6658976/ /pubmed/31391997 http://dx.doi.org/10.1107/S2056989019007576 Text en © Peters et al. 2019 http://creativecommons.org/licenses/by/4.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/4.0/ |
spellingShingle | Research Communications Peters, Morten K. Näther, Christian Herges, Rainer Crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(III)] |
title | Crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(III)] |
title_full | Crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(III)] |
title_fullStr | Crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(III)] |
title_full_unstemmed | Crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(III)] |
title_short | Crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(III)] |
title_sort | crystal structure of a polymorph of μ-oxido-bis[(5,10,15,20-tetraphenylporphyrinato)iron(iii)] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6658976/ https://www.ncbi.nlm.nih.gov/pubmed/31391997 http://dx.doi.org/10.1107/S2056989019007576 |
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