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Crystal structure of tetrakis(isonicotinamide-κN)bis(thiocyanato-κN)cobalt(II)–isonicotinamide–ethanol (1/2/1)
The asymmetric unit of the title compound, [Co(NCS)(2)(C(6)H(6)N(2)O)(4)]·2C(6)H(6)N(2)O·C(2)H(5)OH, comprises one Co(II) cation, two thiocyanate anions, four coordinating and two solvent isonicotinamide molecules and one ethanol solvent molecule. The Co(II) cations are octahedrally coordinated b...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4971845/ https://www.ncbi.nlm.nih.gov/pubmed/27536386 http://dx.doi.org/10.1107/S2056989016010951 |
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author | Neumann, Tristan Jess, Inke Näther, Christian |
author_facet | Neumann, Tristan Jess, Inke Näther, Christian |
author_sort | Neumann, Tristan |
collection | PubMed |
description | The asymmetric unit of the title compound, [Co(NCS)(2)(C(6)H(6)N(2)O)(4)]·2C(6)H(6)N(2)O·C(2)H(5)OH, comprises one Co(II) cation, two thiocyanate anions, four coordinating and two solvent isonicotinamide molecules and one ethanol solvent molecule. The Co(II) cations are octahedrally coordinated by four N-coordinating isonicotinamide ligands and two terminally N-bonded thiocyanate anions. These discrete complexes are linked by intermolecular N—H⋯O and N—H⋯S hydrogen-bonding interactions into a three-dimensional network. The two isonicotinamide and the ethanol solvent molecules are embedded in channels of this network and are linked through further N—H⋯O and N—H⋯N hydrogen bonds to the network. The ethanol solvent molecule is disordered over two sets of sites (occupancy ratio 0.6:0.4). |
format | Online Article Text |
id | pubmed-4971845 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2016 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-49718452016-08-17 Crystal structure of tetrakis(isonicotinamide-κN)bis(thiocyanato-κN)cobalt(II)–isonicotinamide–ethanol (1/2/1) Neumann, Tristan Jess, Inke Näther, Christian Acta Crystallogr E Crystallogr Commun Research Communications The asymmetric unit of the title compound, [Co(NCS)(2)(C(6)H(6)N(2)O)(4)]·2C(6)H(6)N(2)O·C(2)H(5)OH, comprises one Co(II) cation, two thiocyanate anions, four coordinating and two solvent isonicotinamide molecules and one ethanol solvent molecule. The Co(II) cations are octahedrally coordinated by four N-coordinating isonicotinamide ligands and two terminally N-bonded thiocyanate anions. These discrete complexes are linked by intermolecular N—H⋯O and N—H⋯S hydrogen-bonding interactions into a three-dimensional network. The two isonicotinamide and the ethanol solvent molecules are embedded in channels of this network and are linked through further N—H⋯O and N—H⋯N hydrogen bonds to the network. The ethanol solvent molecule is disordered over two sets of sites (occupancy ratio 0.6:0.4). International Union of Crystallography 2016-07-12 /pmc/articles/PMC4971845/ /pubmed/27536386 http://dx.doi.org/10.1107/S2056989016010951 Text en © Neumann et al. 2016 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 | Research Communications Neumann, Tristan Jess, Inke Näther, Christian Crystal structure of tetrakis(isonicotinamide-κN)bis(thiocyanato-κN)cobalt(II)–isonicotinamide–ethanol (1/2/1) |
title | Crystal structure of tetrakis(isonicotinamide-κN)bis(thiocyanato-κN)cobalt(II)–isonicotinamide–ethanol (1/2/1) |
title_full | Crystal structure of tetrakis(isonicotinamide-κN)bis(thiocyanato-κN)cobalt(II)–isonicotinamide–ethanol (1/2/1) |
title_fullStr | Crystal structure of tetrakis(isonicotinamide-κN)bis(thiocyanato-κN)cobalt(II)–isonicotinamide–ethanol (1/2/1) |
title_full_unstemmed | Crystal structure of tetrakis(isonicotinamide-κN)bis(thiocyanato-κN)cobalt(II)–isonicotinamide–ethanol (1/2/1) |
title_short | Crystal structure of tetrakis(isonicotinamide-κN)bis(thiocyanato-κN)cobalt(II)–isonicotinamide–ethanol (1/2/1) |
title_sort | crystal structure of tetrakis(isonicotinamide-κn)bis(thiocyanato-κn)cobalt(ii)–isonicotinamide–ethanol (1/2/1) |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4971845/ https://www.ncbi.nlm.nih.gov/pubmed/27536386 http://dx.doi.org/10.1107/S2056989016010951 |
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