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The structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione
In the structure of the title compound C(33)H(29)BrClNO(4), (I), the hexahydro-2H-acridine ring system has a hydroxyethyl substituent on the N atom and a 3-bromo-6-chloro-2-hydroxyphenyl substituent on the central C atom at the 9-position. An unusual feature of the molecule is that the substit...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6127693/ https://www.ncbi.nlm.nih.gov/pubmed/30225103 http://dx.doi.org/10.1107/S2056989018010873 |
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author | Abdelhamid, Antar A. Hawaiz, Farouq E. Mohamed, Alaa F. Mohamed, Shaaban K. Simpson, Jim |
author_facet | Abdelhamid, Antar A. Hawaiz, Farouq E. Mohamed, Alaa F. Mohamed, Shaaban K. Simpson, Jim |
author_sort | Abdelhamid, Antar A. |
collection | PubMed |
description | In the structure of the title compound C(33)H(29)BrClNO(4), (I), the hexahydro-2H-acridine ring system has a hydroxyethyl substituent on the N atom and a 3-bromo-6-chloro-2-hydroxyphenyl substituent on the central C atom at the 9-position. An unusual feature of the molecule is that the substituents at the 3- and 5-positions of the outer cyclohexenone rings are phenyl rings rather than the more common dimethyl substituents. C atoms on both of the cyclohexenone rings are disordered over two sites. In the crystal structure, O—H⋯O, C—H⋯O and C—H⋯π(ring) hydrogen bonds combine with an Br—O and unusual C—Br⋯π(ring) halogen bonds to generate a three dimensional network with molecules stacked along the a-axis direction. |
format | Online Article Text |
id | pubmed-6127693 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2018 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-61276932018-09-17 The structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione Abdelhamid, Antar A. Hawaiz, Farouq E. Mohamed, Alaa F. Mohamed, Shaaban K. Simpson, Jim Acta Crystallogr E Crystallogr Commun Research Communications In the structure of the title compound C(33)H(29)BrClNO(4), (I), the hexahydro-2H-acridine ring system has a hydroxyethyl substituent on the N atom and a 3-bromo-6-chloro-2-hydroxyphenyl substituent on the central C atom at the 9-position. An unusual feature of the molecule is that the substituents at the 3- and 5-positions of the outer cyclohexenone rings are phenyl rings rather than the more common dimethyl substituents. C atoms on both of the cyclohexenone rings are disordered over two sites. In the crystal structure, O—H⋯O, C—H⋯O and C—H⋯π(ring) hydrogen bonds combine with an Br—O and unusual C—Br⋯π(ring) halogen bonds to generate a three dimensional network with molecules stacked along the a-axis direction. International Union of Crystallography 2018-08-14 /pmc/articles/PMC6127693/ /pubmed/30225103 http://dx.doi.org/10.1107/S2056989018010873 Text en © Abdelhamid et al. 2018 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
spellingShingle | Research Communications Abdelhamid, Antar A. Hawaiz, Farouq E. Mohamed, Alaa F. Mohamed, Shaaban K. Simpson, Jim The structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione |
title | The structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione |
title_full | The structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione |
title_fullStr | The structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione |
title_full_unstemmed | The structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione |
title_short | The structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione |
title_sort | structure of 9-(3-bromo-6-chloro-2-hydroxyphenyl)-10-(2-hydroxyethyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-2h-acridine-1,8-dione |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6127693/ https://www.ncbi.nlm.nih.gov/pubmed/30225103 http://dx.doi.org/10.1107/S2056989018010873 |
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