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3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione
In the title compound, C(26)H(22)ClFO(2), the cyclopropane ring is disordered over two orientations, with site-occupancy factors of 0.64 (2) and 0.36 (2). The major occupancy component of the cyclopropane ring makes dihedral angles of 47.6 (7), 50.4 (7) and 65.4 (7)° with the fluoro-, chloro- and...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3648332/ https://www.ncbi.nlm.nih.gov/pubmed/23723952 http://dx.doi.org/10.1107/S1600536813011276 |
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author | Srinivasan, Thothadri Senthilkumar, Govindaraj Manikandan, Haridoss Gopalakrishnan, Mannathusamy Velmurugan, Devadasan |
author_facet | Srinivasan, Thothadri Senthilkumar, Govindaraj Manikandan, Haridoss Gopalakrishnan, Mannathusamy Velmurugan, Devadasan |
author_sort | Srinivasan, Thothadri |
collection | PubMed |
description | In the title compound, C(26)H(22)ClFO(2), the cyclopropane ring is disordered over two orientations, with site-occupancy factors of 0.64 (2) and 0.36 (2). The major occupancy component of the cyclopropane ring makes dihedral angles of 47.6 (7), 50.4 (7) and 65.4 (7)° with the fluoro-, chloro- and unsubstituted benzene rings, respectively [the corresponding values for the minor occupancy component are 47.6 (12), 51.0 (12) and 60.9 (12)°]. An intramolecular C—H⋯O hydrogen bond occurs. The F and Cl atoms deviate by 0.0508 (12) and 0.0592 (7) Å from the planes of their attached benzene rings. In the crystal, C—H⋯F hydrogen bonds link the molecules into chains along the b-axis direction. |
format | Online Article Text |
id | pubmed-3648332 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-36483322013-05-30 3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione Srinivasan, Thothadri Senthilkumar, Govindaraj Manikandan, Haridoss Gopalakrishnan, Mannathusamy Velmurugan, Devadasan Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(26)H(22)ClFO(2), the cyclopropane ring is disordered over two orientations, with site-occupancy factors of 0.64 (2) and 0.36 (2). The major occupancy component of the cyclopropane ring makes dihedral angles of 47.6 (7), 50.4 (7) and 65.4 (7)° with the fluoro-, chloro- and unsubstituted benzene rings, respectively [the corresponding values for the minor occupancy component are 47.6 (12), 51.0 (12) and 60.9 (12)°]. An intramolecular C—H⋯O hydrogen bond occurs. The F and Cl atoms deviate by 0.0508 (12) and 0.0592 (7) Å from the planes of their attached benzene rings. In the crystal, C—H⋯F hydrogen bonds link the molecules into chains along the b-axis direction. International Union of Crystallography 2013-04-30 /pmc/articles/PMC3648332/ /pubmed/23723952 http://dx.doi.org/10.1107/S1600536813011276 Text en © Srinivasan et al. 2013 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 Srinivasan, Thothadri Senthilkumar, Govindaraj Manikandan, Haridoss Gopalakrishnan, Mannathusamy Velmurugan, Devadasan 3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione |
title | 3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione |
title_full | 3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione |
title_fullStr | 3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione |
title_full_unstemmed | 3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione |
title_short | 3-(4-Chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione |
title_sort | 3-(4-chlorophenyl)-1-cyclopropyl-2-(2-fluorophenyl)-5-phenylpentane-1,5-dione |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3648332/ https://www.ncbi.nlm.nih.gov/pubmed/23723952 http://dx.doi.org/10.1107/S1600536813011276 |
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