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Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate
The crystal structure of the hydrated title salt, 2C(6)H(13)N(2) (+)·S(2)O(3) (2−)·2H(2)O, contains a centrosymmetric cyclic motif of eight hydrogen-bonded molecular subunits. Two DABCOH(+) cations (DABCO = 1,4-diazabicyclo[2.2.2]octane) are linked to two water molecules and two thiosulfate a...
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/PMC4778808/ https://www.ncbi.nlm.nih.gov/pubmed/27006784 http://dx.doi.org/10.1107/S2056989016001535 |
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author | Seck, Gorgui Awa Sene, Aboubacary Diop, Libasse Maris, Thierry |
author_facet | Seck, Gorgui Awa Sene, Aboubacary Diop, Libasse Maris, Thierry |
author_sort | Seck, Gorgui Awa |
collection | PubMed |
description | The crystal structure of the hydrated title salt, 2C(6)H(13)N(2) (+)·S(2)O(3) (2−)·2H(2)O, contains a centrosymmetric cyclic motif of eight hydrogen-bonded molecular subunits. Two DABCOH(+) cations (DABCO = 1,4-diazabicyclo[2.2.2]octane) are linked to two water molecules and two thiosulfate anions via O—H⋯N and O—H⋯O hydrogen bonds, respectively. Two other water molecules close the cyclic motif through O—H⋯O contacts to the first two water molecules and to the two thiosulfate anions. A second pair of DABCOH(+) cations is N—H⋯O hydrogen bonded to the two anions and is pendant to the ring. Adjacent cyclic motifs are bridged into a block-like arrangement extending along [100] through O—H⋯O interactions involving the second pair of water molecules and neighbouring thiosulfate anions. |
format | Online Article Text |
id | pubmed-4778808 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2016 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-47788082016-03-22 Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate Seck, Gorgui Awa Sene, Aboubacary Diop, Libasse Maris, Thierry Acta Crystallogr E Crystallogr Commun Research Communications The crystal structure of the hydrated title salt, 2C(6)H(13)N(2) (+)·S(2)O(3) (2−)·2H(2)O, contains a centrosymmetric cyclic motif of eight hydrogen-bonded molecular subunits. Two DABCOH(+) cations (DABCO = 1,4-diazabicyclo[2.2.2]octane) are linked to two water molecules and two thiosulfate anions via O—H⋯N and O—H⋯O hydrogen bonds, respectively. Two other water molecules close the cyclic motif through O—H⋯O contacts to the first two water molecules and to the two thiosulfate anions. A second pair of DABCOH(+) cations is N—H⋯O hydrogen bonded to the two anions and is pendant to the ring. Adjacent cyclic motifs are bridged into a block-like arrangement extending along [100] through O—H⋯O interactions involving the second pair of water molecules and neighbouring thiosulfate anions. International Union of Crystallography 2016-02-03 /pmc/articles/PMC4778808/ /pubmed/27006784 http://dx.doi.org/10.1107/S2056989016001535 Text en © Seck 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 Seck, Gorgui Awa Sene, Aboubacary Diop, Libasse Maris, Thierry Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate |
title | Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate |
title_full | Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate |
title_fullStr | Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate |
title_full_unstemmed | Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate |
title_short | Crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate |
title_sort | crystal structure of bis(1,4-diazabicyclo[2.2.2]octan-1-ium) thiosulfate dihydrate |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4778808/ https://www.ncbi.nlm.nih.gov/pubmed/27006784 http://dx.doi.org/10.1107/S2056989016001535 |
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