Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one
In the title β-thiocarbonyl compound, C16H16O2S, 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...
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| Format: | Article |
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International Union of Crystallography
2015
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| author | Zukerman-Schpector, J. Olivato, P.R. Traesel, H.J. Valença, J. Rodrigues, D.N.S. Tiekink, E.R.T. |
| author_facet | Zukerman-Schpector, J. Olivato, P.R. Traesel, H.J. Valença, J. Rodrigues, D.N.S. Tiekink, E.R.T. |
| author_sort | Zukerman-Schpector, J. |
| collection | UM |
| description | In the title β-thiocarbonyl compound, C16H16O2S, 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. |
| first_indexed | 2024-03-06T05:47:45Z |
| format | Article |
| id | um.eprints-19260 |
| institution | Universiti Malaya |
| last_indexed | 2024-03-06T05:47:45Z |
| publishDate | 2015 |
| publisher | International Union of Crystallography |
| record_format | dspace |
| spelling | um.eprints-192602018-09-18T08:30:41Z http://eprints.um.edu.my/19260/ Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one Zukerman-Schpector, J. Olivato, P.R. Traesel, H.J. Valença, J. Rodrigues, D.N.S. Tiekink, E.R.T. Q Science (General) QD Chemistry In the title β-thiocarbonyl compound, C16H16O2S, 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 Article PeerReviewed Zukerman-Schpector, J. and Olivato, P.R. and Traesel, H.J. and Valença, J. and Rodrigues, D.N.S. and Tiekink, E.R.T. (2015) Crystal structure of 2-methoxy-2-[(4-methylphenyl)sulfanyl]-1-phenylethan-1-one. Acta Crystallographica Section E: Crystallographic Communications, 71 (1). o3-o4. ISSN 2056-9890, DOI https://doi.org/10.1107/S205698901402550X <https://doi.org/10.1107/S205698901402550X>. http://dx.doi.org/10.1107/S205698901402550X doi:10.1107/S205698901402550X |
| spellingShingle | Q Science (General) QD Chemistry Zukerman-Schpector, J. Olivato, P.R. Traesel, H.J. Valença, J. Rodrigues, D.N.S. Tiekink, E.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 | Q Science (General) QD Chemistry |
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