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Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate
The asymmetric unit of the title compound, [Fe(NCS)(2)(C(6)H(4)N(2))(2)(H(2)O)(2)]·2C(6)H(4)N(2), comprises one Fe(II) cation occupying an inversion centre as well as one thiocyanate anion, one water molecule and two 4-cyanopyridine molecules in general positions. The iron cations are coordinate...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5382599/ https://www.ncbi.nlm.nih.gov/pubmed/28435698 http://dx.doi.org/10.1107/S205698901700322X |
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author | Jochim, Aleksej Jess, Inke Näther, Christian |
author_facet | Jochim, Aleksej Jess, Inke Näther, Christian |
author_sort | Jochim, Aleksej |
collection | PubMed |
description | The asymmetric unit of the title compound, [Fe(NCS)(2)(C(6)H(4)N(2))(2)(H(2)O)(2)]·2C(6)H(4)N(2), comprises one Fe(II) cation occupying an inversion centre as well as one thiocyanate anion, one water molecule and two 4-cyanopyridine molecules in general positions. The iron cations are coordinated by two N-bonded thiocyanate anions, two (pyridine)N-bonded 4-cyanopyridine ligands and two water molecules into discrete complexes. The resulting coordination polyhedron can be described as a slightly distorted octahedron. The discrete complexes are connected through centrosymmetric pairs of (pyridine)C—H⋯N(cyano) hydrogen bonds into chains that are further linked into a three-dimensional network through intermolecular O—H⋯N hydrogen bonds involving the 4-cyanopyridine solvent molecules. |
format | Online Article Text |
id | pubmed-5382599 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2017 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-53825992017-04-21 Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate Jochim, Aleksej Jess, Inke Näther, Christian Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, [Fe(NCS)(2)(C(6)H(4)N(2))(2)(H(2)O)(2)]·2C(6)H(4)N(2), comprises one Fe(II) cation occupying an inversion centre as well as one thiocyanate anion, one water molecule and two 4-cyanopyridine molecules in general positions. The iron cations are coordinated by two N-bonded thiocyanate anions, two (pyridine)N-bonded 4-cyanopyridine ligands and two water molecules into discrete complexes. The resulting coordination polyhedron can be described as a slightly distorted octahedron. The discrete complexes are connected through centrosymmetric pairs of (pyridine)C—H⋯N(cyano) hydrogen bonds into chains that are further linked into a three-dimensional network through intermolecular O—H⋯N hydrogen bonds involving the 4-cyanopyridine solvent molecules. International Union of Crystallography 2017-03-03 /pmc/articles/PMC5382599/ /pubmed/28435698 http://dx.doi.org/10.1107/S205698901700322X Text en © Jochim et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ 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/2.0/uk/ |
spellingShingle | Research Communications Jochim, Aleksej Jess, Inke Näther, Christian Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate |
title | Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate |
title_full | Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate |
title_fullStr | Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate |
title_full_unstemmed | Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate |
title_short | Crystal structure of diaquabis(4-cyanopyridine-κN)bis(thiocyanato-κN)iron(II) 4-cyanopyridine disolvate |
title_sort | crystal structure of diaquabis(4-cyanopyridine-κn)bis(thiocyanato-κn)iron(ii) 4-cyanopyridine disolvate |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5382599/ https://www.ncbi.nlm.nih.gov/pubmed/28435698 http://dx.doi.org/10.1107/S205698901700322X |
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