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Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one
In the title β-thiocarbonyl compound, C(16)H(16)O(2)S, the carbonyl and methoxy O atoms are approximately coplanar [O—C—C—O torsion angle = −18.2 (5)°] and syn to each other, and the tolyl ring is orientated to lie over them. The dihedral angle between the planes of the two rings is 44.03 (16)°. I...
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/PMC4331849/ https://www.ncbi.nlm.nih.gov/pubmed/25705490 http://dx.doi.org/10.1107/S205698901402550X |
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author | Zukerman-Schpector, Julio Olivato, Paulo R. Traesel, Henrique J. Valença, Jéssica Rodrigues, Daniel N. S. Tiekink, Edward R. T. |
author_facet | Zukerman-Schpector, Julio Olivato, Paulo R. Traesel, Henrique J. Valença, Jéssica Rodrigues, Daniel N. S. Tiekink, Edward R. T. |
author_sort | Zukerman-Schpector, Julio |
collection | PubMed |
description | In the title β-thiocarbonyl compound, C(16)H(16)O(2)S, the carbonyl and methoxy O atoms are approximately coplanar [O—C—C—O torsion angle = −18.2 (5)°] and syn to each other, and the tolyl ring is orientated to lie over them. The dihedral angle between the planes of the two rings is 44.03 (16)°. In the crystal, supramolecular chains are formed along the c axis mediated by C—H⋯O interactions involving methine and methyl H atoms as donors, with the carbonyl O atom accepting both bonds; these pack with no specific intermolecular interactions between them. |
format | Online Article Text |
id | pubmed-4331849 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-43318492015-02-20 Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one Zukerman-Schpector, Julio Olivato, Paulo R. Traesel, Henrique J. Valença, Jéssica Rodrigues, Daniel N. S. Tiekink, Edward R. T. Acta Crystallogr E Crystallogr Commun Data Reports In the title β-thiocarbonyl compound, C(16)H(16)O(2)S, the carbonyl and methoxy O atoms are approximately coplanar [O—C—C—O torsion angle = −18.2 (5)°] and syn to each other, and the tolyl ring is orientated to lie over them. The dihedral angle between the planes of the two rings is 44.03 (16)°. In the crystal, supramolecular chains are formed along the c axis mediated by C—H⋯O interactions involving methine and methyl H atoms as donors, with the carbonyl O atom accepting both bonds; these pack with no specific intermolecular interactions between them. International Union of Crystallography 2015-01-01 /pmc/articles/PMC4331849/ /pubmed/25705490 http://dx.doi.org/10.1107/S205698901402550X Text en © Zukerman-Schpector 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 Zukerman-Schpector, Julio Olivato, Paulo R. Traesel, Henrique J. Valença, Jéssica Rodrigues, Daniel N. S. Tiekink, Edward R. T. Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one |
title | Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one |
title_full | Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one |
title_fullStr | Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one |
title_full_unstemmed | Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one |
title_short | Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one |
title_sort | crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4331849/ https://www.ncbi.nlm.nih.gov/pubmed/25705490 http://dx.doi.org/10.1107/S205698901402550X |
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