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3-Acetyl-1-(2,3-dimethylphenyl)thiourea
In the crystal structure of the title compound, C(11)H(14)N(2)OS, the conformation of the two N—H bonds is anti. The conformation of the C=S and the C=O bonds is also anti. Furthermore, the N—H bond adjacent to the benzene ring is anti to the ortho- and meta-methyl groups. The dihedral angle between...
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/PMC3393991/ https://www.ncbi.nlm.nih.gov/pubmed/22798856 http://dx.doi.org/10.1107/S1600536812027973 |
Sumario: | In the crystal structure of the title compound, C(11)H(14)N(2)OS, the conformation of the two N—H bonds is anti. The conformation of the C=S and the C=O bonds is also anti. Furthermore, the N—H bond adjacent to the benzene ring is anti to the ortho- and meta-methyl groups. The dihedral angle between the benzene ring and the side chain [N—C(= S)—N—C(=O)—C; maximum deviation = 0.047 (4) Å] is 81.33 (10)°. The NH hydrogen adjacent to the benzene ring and the amide O atom exhibit bifurcated intra- and intermolecular hydrogen bonding. In the crystal, molecules form inversion dimers, which are linked into chains via R (2) (2)(12) and R (2) (2)(8) networks. |
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