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 C33H29BrClNO4, (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...
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2018-09-01
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| Series: | Acta Crystallographica Section E: Crystallographic Communications |
| Subjects: | |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2056989018010873 |
| _version_ | 1818958248860975104 |
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| author | Antar A. Abdelhamid Farouq E. Hawaiz Alaa F. Mohamed Shaaban K. Mohamed Jim Simpson |
| author_facet | Antar A. Abdelhamid Farouq E. Hawaiz Alaa F. Mohamed Shaaban K. Mohamed Jim Simpson |
| author_sort | Antar A. Abdelhamid |
| collection | DOAJ |
| description | In the structure of the title compound C33H29BrClNO4, (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. |
| first_indexed | 2024-12-20T11:22:44Z |
| format | Article |
| id | doaj.art-0a2e322ba7524b359ea4d9d22d33f540 |
| institution | Directory Open Access Journal |
| issn | 2056-9890 |
| language | English |
| last_indexed | 2024-12-20T11:22:44Z |
| publishDate | 2018-09-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E: Crystallographic Communications |
| spelling | doaj.art-0a2e322ba7524b359ea4d9d22d33f5402022-12-21T19:42:28ZengInternational Union of CrystallographyActa Crystallographica Section E: Crystallographic Communications2056-98902018-09-017491218122110.1107/S2056989018010873ff2154The 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-dioneAntar A. Abdelhamid0Farouq E. Hawaiz1Alaa F. Mohamed2Shaaban K. Mohamed3Jim Simpson4Chemistry Department, Faculty of Science, Sohag University, Sohag, EgyptChemistry Department, College of Education, Salahaddin University-Hawler, Erbil, Kurdistan Region, IraqNational Organization for Drug Control and Research (NODCAR), Giza, EgyptChemistry and Environmental Division, Manchester Metropolitan University, Manchester M1 5GD, England, Chemistry Department, Faculty of Science, Minia University, 61519 El-Minia, EgyptDepartment of Chemistry, University of Otago, PO Box 56, Dunedin, New ZealandIn the structure of the title compound C33H29BrClNO4, (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.http://scripts.iucr.org/cgi-bin/paper?S2056989018010873crystal structuredecaahydroacridinehydrogen bondshalogen bondsC—Br...π(ring) contacts |
| spellingShingle | Antar A. Abdelhamid Farouq E. Hawaiz Alaa F. Mohamed Shaaban K. Mohamed Jim Simpson 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 Acta Crystallographica Section E: Crystallographic Communications crystal structure decaahydroacridine hydrogen bonds halogen bonds C—Br...π(ring) contacts |
| 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 | crystal structure decaahydroacridine hydrogen bonds halogen bonds C—Br...π(ring) contacts |
| url | http://scripts.iucr.org/cgi-bin/paper?S2056989018010873 |
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