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N-(4-Chlorobutanoyl)-N′-[2-(trifluoromethyl)phenyl]thiourea
In the title compound, C(12)H(12)ClF(3)N(2)OS, the dihedral angle between the benzene ring and the thiourea fragment is 69.41 (5)°. The thiourea N—H atoms adopt an anti conformation, such that one of them forms an intramolecular N—H⋯O hydrogen bond, generating an S(6) ring. In the crystal, both N...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3343992/ https://www.ncbi.nlm.nih.gov/pubmed/22589901 http://dx.doi.org/10.1107/S1600536812008859 |
Sumario: | In the title compound, C(12)H(12)ClF(3)N(2)OS, the dihedral angle between the benzene ring and the thiourea fragment is 69.41 (5)°. The thiourea N—H atoms adopt an anti conformation, such that one of them forms an intramolecular N—H⋯O hydrogen bond, generating an S(6) ring. In the crystal, both N—H groups form inversion dimers, one via a pair of N—H⋯S hydrogen bonds and one via a pair of N—H⋯O hydrogen bonds. These lead to R (2) (2)(8) and R (2) (2)(12) loops, respectively. Weak C—H⋯Cl, C—H⋯F, C—H⋯S and π–π [centroid–centroid separation = 3.7098 (6)Å and slippage = 1.853 Å] interactions also occur. |
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