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Crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate
The porphyrin core of the title centrosymmetric compound, C(44)H(26)N(8)O(8)·2C(6)H(5)NO(2), is approximately planar, the maximum deviation being 0.069 (3) Å. The planes of the benzene rings of the nitrophenyl substituents are almost perpendicular to the porphyrin mean plane, making dihedral angles...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257332/ https://www.ncbi.nlm.nih.gov/pubmed/25484793 http://dx.doi.org/10.1107/S1600536814021503 |
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author | Seredyuk, Maksym Gumienna–Kontecka, Elzbieta Brzuszkiewicz, Anna Iskenderov, Turganbay S. Kalibabchuk, Valentina A. |
author_facet | Seredyuk, Maksym Gumienna–Kontecka, Elzbieta Brzuszkiewicz, Anna Iskenderov, Turganbay S. Kalibabchuk, Valentina A. |
author_sort | Seredyuk, Maksym |
collection | PubMed |
description | The porphyrin core of the title centrosymmetric compound, C(44)H(26)N(8)O(8)·2C(6)H(5)NO(2), is approximately planar, the maximum deviation being 0.069 (3) Å. The planes of the benzene rings of the nitrophenyl substituents are almost perpendicular to the porphyrin mean plane, making dihedral angles of 73.89 (9) and 89.24 (9)°. The two pyrrole ring H atoms are equally disordered over the four pyrrole ring N atoms. In the crystal, weak C—H⋯O and C—H⋯N hydrogen bonds link the porphyrin molecules into a three-dimensional supramolecular network. The nitrobenzene solvent molecules are linked by weak C—H⋯O hydrogen bonds into supramolecular chains propagating along the a-axis direction. |
format | Online Article Text |
id | pubmed-4257332 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-42573322014-12-05 Crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate Seredyuk, Maksym Gumienna–Kontecka, Elzbieta Brzuszkiewicz, Anna Iskenderov, Turganbay S. Kalibabchuk, Valentina A. Acta Crystallogr Sect E Struct Rep Online Data Reports The porphyrin core of the title centrosymmetric compound, C(44)H(26)N(8)O(8)·2C(6)H(5)NO(2), is approximately planar, the maximum deviation being 0.069 (3) Å. The planes of the benzene rings of the nitrophenyl substituents are almost perpendicular to the porphyrin mean plane, making dihedral angles of 73.89 (9) and 89.24 (9)°. The two pyrrole ring H atoms are equally disordered over the four pyrrole ring N atoms. In the crystal, weak C—H⋯O and C—H⋯N hydrogen bonds link the porphyrin molecules into a three-dimensional supramolecular network. The nitrobenzene solvent molecules are linked by weak C—H⋯O hydrogen bonds into supramolecular chains propagating along the a-axis direction. International Union of Crystallography 2014-10-04 /pmc/articles/PMC4257332/ /pubmed/25484793 http://dx.doi.org/10.1107/S1600536814021503 Text en © Seredyuk et al. 2014 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Data Reports Seredyuk, Maksym Gumienna–Kontecka, Elzbieta Brzuszkiewicz, Anna Iskenderov, Turganbay S. Kalibabchuk, Valentina A. Crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate |
title | Crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate |
title_full | Crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate |
title_fullStr | Crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate |
title_full_unstemmed | Crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate |
title_short | Crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate |
title_sort | crystal structure of meso-tetrakis(4-nitrophenyl)porphyrin nitrobenzene disolvate |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257332/ https://www.ncbi.nlm.nih.gov/pubmed/25484793 http://dx.doi.org/10.1107/S1600536814021503 |
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