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Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ(4) N (29),N (30),N (31),N (32))ferrate(II) acetone disolvate
The crystal structure of the title compound, (C(24)H(20)P)(2)[Fe(C(36)H(20)N(4))(CN)(2)]·2C(3)H(6)O, is constructed from a tetrahedral Ph(4)P(+) (tetraphenylphosphonium) cation, one [Fe(tbp)(CN)(2)](2−) anion (tbp = tetrabenzoporphyrin in its doubly deprotonated form), located on a centre of in...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384569/ https://www.ncbi.nlm.nih.gov/pubmed/25878850 http://dx.doi.org/10.1107/S2056989015001735 |
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author | Nishi, Miki Matsuda, Masaki Hoshino, Norihisa Akutagawa, Tomoyuki |
author_facet | Nishi, Miki Matsuda, Masaki Hoshino, Norihisa Akutagawa, Tomoyuki |
author_sort | Nishi, Miki |
collection | PubMed |
description | The crystal structure of the title compound, (C(24)H(20)P)(2)[Fe(C(36)H(20)N(4))(CN)(2)]·2C(3)H(6)O, is constructed from a tetrahedral Ph(4)P(+) (tetraphenylphosphonium) cation, one [Fe(tbp)(CN)(2)](2−) anion (tbp = tetrabenzoporphyrin in its doubly deprotonated form), located on a centre of inversion, and an acetone molecule as crystallization solvent. Since the molecular structure of the M(tbp) moiety is insensitive to the kind of metal ion and its oxidation state, bond lengths and angles in the [Fe(tbp)(CN)(2)](2−) anion are similar to those in other M(tbp) compounds. The Fe(2+) ion, located on a centre of inversion, is coordinated by four N atoms of tpb in the equatorial plane and by two C atoms of the cyanide anion at axial positions in a slightly distorted octahedral configuration. The packing is stabilized by C—H⋯N interactions between the Ph(4)P(+) cation and the CN(−) ligand of the [Fe(tbp)(CN)(2)](2−) anion, and by C—H⋯π interactions between the Ph(4)P(+) cation, acetone solvent molecules and the [Fe(tbp)(CN)(2)](2−) anion. |
format | Online Article Text |
id | pubmed-4384569 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-43845692015-04-15 Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ(4) N (29),N (30),N (31),N (32))ferrate(II) acetone disolvate Nishi, Miki Matsuda, Masaki Hoshino, Norihisa Akutagawa, Tomoyuki Acta Crystallogr E Crystallogr Commun Data Reports The crystal structure of the title compound, (C(24)H(20)P)(2)[Fe(C(36)H(20)N(4))(CN)(2)]·2C(3)H(6)O, is constructed from a tetrahedral Ph(4)P(+) (tetraphenylphosphonium) cation, one [Fe(tbp)(CN)(2)](2−) anion (tbp = tetrabenzoporphyrin in its doubly deprotonated form), located on a centre of inversion, and an acetone molecule as crystallization solvent. Since the molecular structure of the M(tbp) moiety is insensitive to the kind of metal ion and its oxidation state, bond lengths and angles in the [Fe(tbp)(CN)(2)](2−) anion are similar to those in other M(tbp) compounds. The Fe(2+) ion, located on a centre of inversion, is coordinated by four N atoms of tpb in the equatorial plane and by two C atoms of the cyanide anion at axial positions in a slightly distorted octahedral configuration. The packing is stabilized by C—H⋯N interactions between the Ph(4)P(+) cation and the CN(−) ligand of the [Fe(tbp)(CN)(2)](2−) anion, and by C—H⋯π interactions between the Ph(4)P(+) cation, acetone solvent molecules and the [Fe(tbp)(CN)(2)](2−) anion. International Union of Crystallography 2015-01-31 /pmc/articles/PMC4384569/ /pubmed/25878850 http://dx.doi.org/10.1107/S2056989015001735 Text en © Nishi et al. 2015 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 Nishi, Miki Matsuda, Masaki Hoshino, Norihisa Akutagawa, Tomoyuki Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ(4) N (29),N (30),N (31),N (32))ferrate(II) acetone disolvate |
title | Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ(4)
N
(29),N
(30),N
(31),N
(32))ferrate(II) acetone disolvate |
title_full | Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ(4)
N
(29),N
(30),N
(31),N
(32))ferrate(II) acetone disolvate |
title_fullStr | Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ(4)
N
(29),N
(30),N
(31),N
(32))ferrate(II) acetone disolvate |
title_full_unstemmed | Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ(4)
N
(29),N
(30),N
(31),N
(32))ferrate(II) acetone disolvate |
title_short | Crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κC)(29H,31H-tetrabenzo[b,g,l,q]porphinato-κ(4)
N
(29),N
(30),N
(31),N
(32))ferrate(II) acetone disolvate |
title_sort | crystal structure of bis(tetraphenylphosphonium) bis(cyanido-κc)(29h,31h-tetrabenzo[b,g,l,q]porphinato-κ(4)
n
(29),n
(30),n
(31),n
(32))ferrate(ii) acetone disolvate |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384569/ https://www.ncbi.nlm.nih.gov/pubmed/25878850 http://dx.doi.org/10.1107/S2056989015001735 |
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