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2-[(2-Hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1)
In the crystal structure of the title co-crystal, C(11)H(12)N(3)O(+)·ClO(4) (−)·C(11)H(11)N(3)O, the perchlorate ion is disordered about a twofold rotation axis with the Cl atom located on the twofold rotation axis; the 2-[(2-hydroxybenzyl)amino]pyrazinium cation and the neutral 2-[(pyrazin-2-yl...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414930/ https://www.ncbi.nlm.nih.gov/pubmed/22904917 http://dx.doi.org/10.1107/S1600536812031558 |
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author | Gao, Shan Ng, Seik Weng |
author_facet | Gao, Shan Ng, Seik Weng |
author_sort | Gao, Shan |
collection | PubMed |
description | In the crystal structure of the title co-crystal, C(11)H(12)N(3)O(+)·ClO(4) (−)·C(11)H(11)N(3)O, the perchlorate ion is disordered about a twofold rotation axis with the Cl atom located on the twofold rotation axis; the 2-[(2-hydroxybenzyl)amino]pyrazinium cation and the neutral 2-[(pyrazin-2-ylamino)methyl]phenol molecule are disordered about the rotation axis in a 1:1 ratio. These two are connected by a pyrazine–pyrazine N(1)—H⋯N(4) hydrogen bond. The cation, whose two aromatic rings are twisted along the –CH(2)—NH– bond by 76.8 (1)°, is a hydrogen-bond donor to the perchlorate ion through the N atom of this link. |
format | Online Article Text |
id | pubmed-3414930 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-34149302012-08-17 2-[(2-Hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1) Gao, Shan Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the title co-crystal, C(11)H(12)N(3)O(+)·ClO(4) (−)·C(11)H(11)N(3)O, the perchlorate ion is disordered about a twofold rotation axis with the Cl atom located on the twofold rotation axis; the 2-[(2-hydroxybenzyl)amino]pyrazinium cation and the neutral 2-[(pyrazin-2-ylamino)methyl]phenol molecule are disordered about the rotation axis in a 1:1 ratio. These two are connected by a pyrazine–pyrazine N(1)—H⋯N(4) hydrogen bond. The cation, whose two aromatic rings are twisted along the –CH(2)—NH– bond by 76.8 (1)°, is a hydrogen-bond donor to the perchlorate ion through the N atom of this link. International Union of Crystallography 2012-07-18 /pmc/articles/PMC3414930/ /pubmed/22904917 http://dx.doi.org/10.1107/S1600536812031558 Text en © Gao and Ng 2012 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 | Organic Papers Gao, Shan Ng, Seik Weng 2-[(2-Hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1) |
title | 2-[(2-Hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1) |
title_full | 2-[(2-Hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1) |
title_fullStr | 2-[(2-Hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1) |
title_full_unstemmed | 2-[(2-Hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1) |
title_short | 2-[(2-Hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1) |
title_sort | 2-[(2-hydroxybenzyl)amino]pyrazinium perchlorate–2-[(pyrazin-2-ylamino)methyl]phenol (1/1) |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414930/ https://www.ncbi.nlm.nih.gov/pubmed/22904917 http://dx.doi.org/10.1107/S1600536812031558 |
work_keys_str_mv | AT gaoshan 22hydroxybenzylaminopyraziniumperchlorate2pyrazin2ylaminomethylphenol11 AT ngseikweng 22hydroxybenzylaminopyraziniumperchlorate2pyrazin2ylaminomethylphenol11 |