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Crystal structure of (7-methyl-2-oxo-2H-chromen-4-yl)methyl piperidine-1-carbodithioate
In the title compound, C(17)H(19)NO(2)S(2), the 2H-chromene ring system is nearly planar, with a maximum deviation of 0.0383 (28) Å, and the piperidine ring adopts a chair conformation. The 2H-chromene ring makes dihedral angles of 32.89 (16) and 67.33 (8)°, respectively, with the mean planes of the...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571421/ https://www.ncbi.nlm.nih.gov/pubmed/26396821 http://dx.doi.org/10.1107/S2056989015013699 |
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author | Roopashree, K. R. Meenakshi, T. G. Kumar, K. Mahesh Kotresh, O. Devarajegowda, H. C. |
author_facet | Roopashree, K. R. Meenakshi, T. G. Kumar, K. Mahesh Kotresh, O. Devarajegowda, H. C. |
author_sort | Roopashree, K. R. |
collection | PubMed |
description | In the title compound, C(17)H(19)NO(2)S(2), the 2H-chromene ring system is nearly planar, with a maximum deviation of 0.0383 (28) Å, and the piperidine ring adopts a chair conformation. The 2H-chromene ring makes dihedral angles of 32.89 (16) and 67.33 (8)°, respectively, with the mean planes of the piperidine ring and the carbodithioate group. In the crystal, C—H⋯O and weak C—H⋯S hydrogen bonds link the molecules into chains along [001]. The crystal structure also features C—H⋯π and π–π interactions, with a centroid–centroid distance of 3.7097 (17) Å. |
format | Online Article Text |
id | pubmed-4571421 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-45714212015-09-22 Crystal structure of (7-methyl-2-oxo-2H-chromen-4-yl)methyl piperidine-1-carbodithioate Roopashree, K. R. Meenakshi, T. G. Kumar, K. Mahesh Kotresh, O. Devarajegowda, H. C. Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(17)H(19)NO(2)S(2), the 2H-chromene ring system is nearly planar, with a maximum deviation of 0.0383 (28) Å, and the piperidine ring adopts a chair conformation. The 2H-chromene ring makes dihedral angles of 32.89 (16) and 67.33 (8)°, respectively, with the mean planes of the piperidine ring and the carbodithioate group. In the crystal, C—H⋯O and weak C—H⋯S hydrogen bonds link the molecules into chains along [001]. The crystal structure also features C—H⋯π and π–π interactions, with a centroid–centroid distance of 3.7097 (17) Å. International Union of Crystallography 2015-07-29 /pmc/articles/PMC4571421/ /pubmed/26396821 http://dx.doi.org/10.1107/S2056989015013699 Text en © Roopashree et al. 2015 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 | Data Reports Roopashree, K. R. Meenakshi, T. G. Kumar, K. Mahesh Kotresh, O. Devarajegowda, H. C. Crystal structure of (7-methyl-2-oxo-2H-chromen-4-yl)methyl piperidine-1-carbodithioate |
title | Crystal structure of (7-methyl-2-oxo-2H-chromen-4-yl)methyl piperidine-1-carbodithioate |
title_full | Crystal structure of (7-methyl-2-oxo-2H-chromen-4-yl)methyl piperidine-1-carbodithioate |
title_fullStr | Crystal structure of (7-methyl-2-oxo-2H-chromen-4-yl)methyl piperidine-1-carbodithioate |
title_full_unstemmed | Crystal structure of (7-methyl-2-oxo-2H-chromen-4-yl)methyl piperidine-1-carbodithioate |
title_short | Crystal structure of (7-methyl-2-oxo-2H-chromen-4-yl)methyl piperidine-1-carbodithioate |
title_sort | crystal structure of (7-methyl-2-oxo-2h-chromen-4-yl)methyl piperidine-1-carbodithioate |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571421/ https://www.ncbi.nlm.nih.gov/pubmed/26396821 http://dx.doi.org/10.1107/S2056989015013699 |
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