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Crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate
In the title hydrated salt, C(12)H(8)Br(2)N(3)O(+)·Br(−)·H(2)O, which was synthesized by the reaction of the pyridine derivative Schiff base N (1),N (4)-bis(pyridine-2-ylmethylene)benzene-1,4-diamine with bromine, the asymmetric unit contains a 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4645018/ https://www.ncbi.nlm.nih.gov/pubmed/26594504 http://dx.doi.org/10.1107/S2056989015018253 |
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author | Faizi, Md. Serajul Haque Parashchenko, Yuliia |
author_facet | Faizi, Md. Serajul Haque Parashchenko, Yuliia |
author_sort | Faizi, Md. Serajul Haque |
collection | PubMed |
description | In the title hydrated salt, C(12)H(8)Br(2)N(3)O(+)·Br(−)·H(2)O, which was synthesized by the reaction of the pyridine derivative Schiff base N (1),N (4)-bis(pyridine-2-ylmethylene)benzene-1,4-diamine with bromine, the asymmetric unit contains a 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium cation, with a protonated pyridine moiety, a bromide anion and a water molecule of solvation. The cation is non-planar with the dibromo-substituted benzene ring, forming dihedral angles of 24.3 (4) and 11.5 (4)° with the fused pyridine and pyrazine ring moieties, respectively. In the crystal, the cations are linked through a centrosymmetric hydrogen-bonded cyclic R (4) (2)(8) Br(2)(H(2)O)(2) unit by N—H⋯Br, N—H⋯O and O—H⋯Br hydrogen bonds, forming one-dimensional ribbons extending along b, with the planes of the cations lying parallel to (100). |
format | Online Article Text |
id | pubmed-4645018 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-46450182015-11-20 Crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate Faizi, Md. Serajul Haque Parashchenko, Yuliia Acta Crystallogr E Crystallogr Commun Research Communications In the title hydrated salt, C(12)H(8)Br(2)N(3)O(+)·Br(−)·H(2)O, which was synthesized by the reaction of the pyridine derivative Schiff base N (1),N (4)-bis(pyridine-2-ylmethylene)benzene-1,4-diamine with bromine, the asymmetric unit contains a 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium cation, with a protonated pyridine moiety, a bromide anion and a water molecule of solvation. The cation is non-planar with the dibromo-substituted benzene ring, forming dihedral angles of 24.3 (4) and 11.5 (4)° with the fused pyridine and pyrazine ring moieties, respectively. In the crystal, the cations are linked through a centrosymmetric hydrogen-bonded cyclic R (4) (2)(8) Br(2)(H(2)O)(2) unit by N—H⋯Br, N—H⋯O and O—H⋯Br hydrogen bonds, forming one-dimensional ribbons extending along b, with the planes of the cations lying parallel to (100). International Union of Crystallography 2015-10-17 /pmc/articles/PMC4645018/ /pubmed/26594504 http://dx.doi.org/10.1107/S2056989015018253 Text en © Faizi and Parashchenko 2015 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 Faizi, Md. Serajul Haque Parashchenko, Yuliia Crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate |
title | Crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate |
title_full | Crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate |
title_fullStr | Crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate |
title_full_unstemmed | Crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate |
title_short | Crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate |
title_sort | crystal structure of 2-amino-1,3-dibromo-6-oxo-5,6-dihydropyrido[1,2-a]quinoxalin-11-ium bromide monohydrate |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4645018/ https://www.ncbi.nlm.nih.gov/pubmed/26594504 http://dx.doi.org/10.1107/S2056989015018253 |
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