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2,5-Bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate
The title compound, C(12)H(18)N(2)O(4)·H(2)O, was obtained as a product of the reaction of hydroquinone with n-propanol amine. The compound crystallizes as a monohydrate, integrating water into its hydrogen-bonded network. Each diaminoquinone moiety forms two centrosymmetric 10-membered rings thro...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3152041/ https://www.ncbi.nlm.nih.gov/pubmed/21837038 http://dx.doi.org/10.1107/S1600536811021635 |
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author | Wang, Jian Liu, Weiwei Guan, Tongwei Yin, Fujun Sun, Yuxi |
author_facet | Wang, Jian Liu, Weiwei Guan, Tongwei Yin, Fujun Sun, Yuxi |
author_sort | Wang, Jian |
collection | PubMed |
description | The title compound, C(12)H(18)N(2)O(4)·H(2)O, was obtained as a product of the reaction of hydroquinone with n-propanol amine. The compound crystallizes as a monohydrate, integrating water into its hydrogen-bonded network. Each diaminoquinone moiety forms two centrosymmetric 10-membered rings through C=O⋯H—N bonds. The resulting bands along [102] are interlinked through hydroxy groups and water molecules into three-dimensional network. The chemically equivalent bond lengths in the diaminoquinone moiety exhibit a perceptible discrepancy [e.g. C=O bond lengths differ by 0.016 (2) Å], apparently as a result of asymmetric hydrogen bonding: one O atom serves as an acceptor of one hydrogen bond, whereas the other is an acceptor of two. |
format | Online Article Text |
id | pubmed-3152041 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-31520412011-08-11 2,5-Bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate Wang, Jian Liu, Weiwei Guan, Tongwei Yin, Fujun Sun, Yuxi Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(12)H(18)N(2)O(4)·H(2)O, was obtained as a product of the reaction of hydroquinone with n-propanol amine. The compound crystallizes as a monohydrate, integrating water into its hydrogen-bonded network. Each diaminoquinone moiety forms two centrosymmetric 10-membered rings through C=O⋯H—N bonds. The resulting bands along [102] are interlinked through hydroxy groups and water molecules into three-dimensional network. The chemically equivalent bond lengths in the diaminoquinone moiety exhibit a perceptible discrepancy [e.g. C=O bond lengths differ by 0.016 (2) Å], apparently as a result of asymmetric hydrogen bonding: one O atom serves as an acceptor of one hydrogen bond, whereas the other is an acceptor of two. International Union of Crystallography 2011-06-11 /pmc/articles/PMC3152041/ /pubmed/21837038 http://dx.doi.org/10.1107/S1600536811021635 Text en © Wang et al. 2011 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 Wang, Jian Liu, Weiwei Guan, Tongwei Yin, Fujun Sun, Yuxi 2,5-Bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate |
title | 2,5-Bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate |
title_full | 2,5-Bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate |
title_fullStr | 2,5-Bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate |
title_full_unstemmed | 2,5-Bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate |
title_short | 2,5-Bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate |
title_sort | 2,5-bis[(3-hydroxypropyl)amino]-1,4-benzoquinone monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3152041/ https://www.ncbi.nlm.nih.gov/pubmed/21837038 http://dx.doi.org/10.1107/S1600536811021635 |
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