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Crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(II) and tetraethanolbis(thiocyanato)cobalt(II)–urotropine (1/2)
The reaction of one equivalent Co(NCS)(2) with four equivalents of urotropine (hexamethylenetetramine) in ethanol leads to the formation of two compounds, namely, bis(ethanol-κO)bis(thiocyanato-κN)bis(urotropine-κN)cobalt(II), [Co(NCS)(2)(C(6)H(12)N(4))(2)(C(2)H(6)O)(2)] (1), and tetrakis(...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8739191/ https://www.ncbi.nlm.nih.gov/pubmed/35079427 http://dx.doi.org/10.1107/S2056989021013281 |
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author | Krebs, Christoph Jess, Inke Ceglarska, Magdalena Näther, Christian |
author_facet | Krebs, Christoph Jess, Inke Ceglarska, Magdalena Näther, Christian |
author_sort | Krebs, Christoph |
collection | PubMed |
description | The reaction of one equivalent Co(NCS)(2) with four equivalents of urotropine (hexamethylenetetramine) in ethanol leads to the formation of two compounds, namely, bis(ethanol-κO)bis(thiocyanato-κN)bis(urotropine-κN)cobalt(II), [Co(NCS)(2)(C(6)H(12)N(4))(2)(C(2)H(6)O)(2)] (1), and tetrakis(ethanol-κO)bis(thiocyanato-κN)cobalt(II)–urotropine (1/2), [Co(NCS)(2)(C(2)H(6)O)(4)]·2C(6)H(12)N(4) (2). In 1, the Co cations are located on centers of inversion and are sixfold coordinated by two terminal N-bonded thiocyanate anions, two ethanol and two urotropine ligands whereas in 2 the cobalt cations occupy position Wyckoff position c and are sixfold coordinated by two anionic ligands and four ethanol ligands. Compound 2 contains two additional urotropine solvate molecules per formula unit, which are hydrogen bonded to the complexes. In both compounds, the building blocks are connected via intermolecular O—H⋯N (1 and 2) and C—H⋯S (1) hydrogen bonding to form three-dimensional networks. |
format | Online Article Text |
id | pubmed-8739191 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2022 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-87391912022-01-24 Crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(II) and tetraethanolbis(thiocyanato)cobalt(II)–urotropine (1/2) Krebs, Christoph Jess, Inke Ceglarska, Magdalena Näther, Christian Acta Crystallogr E Crystallogr Commun Research Communications The reaction of one equivalent Co(NCS)(2) with four equivalents of urotropine (hexamethylenetetramine) in ethanol leads to the formation of two compounds, namely, bis(ethanol-κO)bis(thiocyanato-κN)bis(urotropine-κN)cobalt(II), [Co(NCS)(2)(C(6)H(12)N(4))(2)(C(2)H(6)O)(2)] (1), and tetrakis(ethanol-κO)bis(thiocyanato-κN)cobalt(II)–urotropine (1/2), [Co(NCS)(2)(C(2)H(6)O)(4)]·2C(6)H(12)N(4) (2). In 1, the Co cations are located on centers of inversion and are sixfold coordinated by two terminal N-bonded thiocyanate anions, two ethanol and two urotropine ligands whereas in 2 the cobalt cations occupy position Wyckoff position c and are sixfold coordinated by two anionic ligands and four ethanol ligands. Compound 2 contains two additional urotropine solvate molecules per formula unit, which are hydrogen bonded to the complexes. In both compounds, the building blocks are connected via intermolecular O—H⋯N (1 and 2) and C—H⋯S (1) hydrogen bonding to form three-dimensional networks. International Union of Crystallography 2022-01-01 /pmc/articles/PMC8739191/ /pubmed/35079427 http://dx.doi.org/10.1107/S2056989021013281 Text en © Krebs et al. 2022 https://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. |
spellingShingle | Research Communications Krebs, Christoph Jess, Inke Ceglarska, Magdalena Näther, Christian Crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(II) and tetraethanolbis(thiocyanato)cobalt(II)–urotropine (1/2) |
title | Crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(II) and tetraethanolbis(thiocyanato)cobalt(II)–urotropine (1/2) |
title_full | Crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(II) and tetraethanolbis(thiocyanato)cobalt(II)–urotropine (1/2) |
title_fullStr | Crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(II) and tetraethanolbis(thiocyanato)cobalt(II)–urotropine (1/2) |
title_full_unstemmed | Crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(II) and tetraethanolbis(thiocyanato)cobalt(II)–urotropine (1/2) |
title_short | Crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(II) and tetraethanolbis(thiocyanato)cobalt(II)–urotropine (1/2) |
title_sort | crystal structure of diethanolbis(thiocyanato)bis(urotropine)cobalt(ii) and tetraethanolbis(thiocyanato)cobalt(ii)–urotropine (1/2) |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8739191/ https://www.ncbi.nlm.nih.gov/pubmed/35079427 http://dx.doi.org/10.1107/S2056989021013281 |
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