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Marbofloxacin
In the title compound, [systematic name: 9-fluoro-2,3-dihydro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-7H-pyrido[1,2,3-ij][1,2,4]benzoxadiazine-6-carboxylic acid], C(17)H(19)FN(4)O(4), the carbonyl and carboxyl groups are coplanar with the quinoline ring, making a dihedral angle of 2.39 (2)°. T...
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/PMC3343966/ https://www.ncbi.nlm.nih.gov/pubmed/22590047 http://dx.doi.org/10.1107/S1600536812009312 |
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author | Shen, Jin Qian, Jing-Jing Gu, Jian-Ming Hu, Xiu-Rong |
author_facet | Shen, Jin Qian, Jing-Jing Gu, Jian-Ming Hu, Xiu-Rong |
author_sort | Shen, Jin |
collection | PubMed |
description | In the title compound, [systematic name: 9-fluoro-2,3-dihydro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-7H-pyrido[1,2,3-ij][1,2,4]benzoxadiazine-6-carboxylic acid], C(17)H(19)FN(4)O(4), the carbonyl and carboxyl groups are coplanar with the quinoline ring, making a dihedral angle of 2.39 (2)°. The piperazine ring adopts a chair conformation and the oxadiazinane ring displays an envelope conformation with the CH(2) group at the flap displaced by 0.650 (2) Å from the plane through the other five atoms. The molecular structure exhibits an S(6) ring motif, owing to an intramolecular O—H⋯O hydrogen bond. In the crystal, weak C—H⋯F hydrogen bonds link molecules into layers parallel to the ab plane. |
format | Online Article Text |
id | pubmed-3343966 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2012 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-33439662012-05-15 Marbofloxacin Shen, Jin Qian, Jing-Jing Gu, Jian-Ming Hu, Xiu-Rong Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, [systematic name: 9-fluoro-2,3-dihydro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-7H-pyrido[1,2,3-ij][1,2,4]benzoxadiazine-6-carboxylic acid], C(17)H(19)FN(4)O(4), the carbonyl and carboxyl groups are coplanar with the quinoline ring, making a dihedral angle of 2.39 (2)°. The piperazine ring adopts a chair conformation and the oxadiazinane ring displays an envelope conformation with the CH(2) group at the flap displaced by 0.650 (2) Å from the plane through the other five atoms. The molecular structure exhibits an S(6) ring motif, owing to an intramolecular O—H⋯O hydrogen bond. In the crystal, weak C—H⋯F hydrogen bonds link molecules into layers parallel to the ab plane. International Union of Crystallography 2012-03-10 /pmc/articles/PMC3343966/ /pubmed/22590047 http://dx.doi.org/10.1107/S1600536812009312 Text en © Shen et al. 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 Shen, Jin Qian, Jing-Jing Gu, Jian-Ming Hu, Xiu-Rong Marbofloxacin |
title | Marbofloxacin |
title_full | Marbofloxacin |
title_fullStr | Marbofloxacin |
title_full_unstemmed | Marbofloxacin |
title_short | Marbofloxacin |
title_sort | marbofloxacin |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3343966/ https://www.ncbi.nlm.nih.gov/pubmed/22590047 http://dx.doi.org/10.1107/S1600536812009312 |
work_keys_str_mv | AT shenjin marbofloxacin AT qianjingjing marbofloxacin AT gujianming marbofloxacin AT huxiurong marbofloxacin |