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3-Methyl-1-tosyl-1H-indole-2-carbaldehyde
The title indole derivative, C(17)H(15)NO(3)S, crystallizes with two independent molecules in the asymmetric unit. The benzene ring of the tosyl group is almost perpedicular to the indole ring in both molecules, with interplanar angles of 82.60 (5)° and 81.82 (6)°. The two molecules are, as a co...
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/PMC3569754/ https://www.ncbi.nlm.nih.gov/pubmed/23424500 http://dx.doi.org/10.1107/S160053681205180X |
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author | Pradeep, Priyamvada Khorasani, Sanaz de Koning, Charles B. Fernandes, Manuel A. |
author_facet | Pradeep, Priyamvada Khorasani, Sanaz de Koning, Charles B. Fernandes, Manuel A. |
author_sort | Pradeep, Priyamvada |
collection | PubMed |
description | The title indole derivative, C(17)H(15)NO(3)S, crystallizes with two independent molecules in the asymmetric unit. The benzene ring of the tosyl group is almost perpedicular to the indole ring in both molecules, with interplanar angles of 82.60 (5)° and 81.82 (6)°. The two molecules are, as a consequence, able to form an almost centrosymmetric non-bonded dimer, in which the molecules are linked by pairs of C—H⋯π interactions. The crystal structure displays a three-dimensional network of C—H⋯O interactions. A π–π interaction occurs between inversion-related indole rings with a centroid–centroid distance of 3.6774 (16) Å and an interplanar angle of 1.53 (15)°. This interaction leads to a stacking of molecules along the a axis. |
format | Online Article Text |
id | pubmed-3569754 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-35697542013-02-19 3-Methyl-1-tosyl-1H-indole-2-carbaldehyde Pradeep, Priyamvada Khorasani, Sanaz de Koning, Charles B. Fernandes, Manuel A. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title indole derivative, C(17)H(15)NO(3)S, crystallizes with two independent molecules in the asymmetric unit. The benzene ring of the tosyl group is almost perpedicular to the indole ring in both molecules, with interplanar angles of 82.60 (5)° and 81.82 (6)°. The two molecules are, as a consequence, able to form an almost centrosymmetric non-bonded dimer, in which the molecules are linked by pairs of C—H⋯π interactions. The crystal structure displays a three-dimensional network of C—H⋯O interactions. A π–π interaction occurs between inversion-related indole rings with a centroid–centroid distance of 3.6774 (16) Å and an interplanar angle of 1.53 (15)°. This interaction leads to a stacking of molecules along the a axis. International Union of Crystallography 2013-01-12 /pmc/articles/PMC3569754/ /pubmed/23424500 http://dx.doi.org/10.1107/S160053681205180X Text en © Pradeep 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 Pradeep, Priyamvada Khorasani, Sanaz de Koning, Charles B. Fernandes, Manuel A. 3-Methyl-1-tosyl-1H-indole-2-carbaldehyde |
title | 3-Methyl-1-tosyl-1H-indole-2-carbaldehyde |
title_full | 3-Methyl-1-tosyl-1H-indole-2-carbaldehyde |
title_fullStr | 3-Methyl-1-tosyl-1H-indole-2-carbaldehyde |
title_full_unstemmed | 3-Methyl-1-tosyl-1H-indole-2-carbaldehyde |
title_short | 3-Methyl-1-tosyl-1H-indole-2-carbaldehyde |
title_sort | 3-methyl-1-tosyl-1h-indole-2-carbaldehyde |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569754/ https://www.ncbi.nlm.nih.gov/pubmed/23424500 http://dx.doi.org/10.1107/S160053681205180X |
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