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Crystal structure of 2-oxo-1,2-diphenylethyl diisopropylcarbamate
The title compound, C(21)H(25)NO(3), crystallized as a racemic twin in the Sohnke space group P2(1). In the molecular structure of the title compound, both enantiomers show a highly similar conformation with the urethane function and the benzoyl group showing an almost perpendicular arrangement [t...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8587984/ https://www.ncbi.nlm.nih.gov/pubmed/34868642 http://dx.doi.org/10.1107/S2056989021010367 |
Sumario: | The title compound, C(21)H(25)NO(3), crystallized as a racemic twin in the Sohnke space group P2(1). In the molecular structure of the title compound, both enantiomers show a highly similar conformation with the urethane function and the benzoyl group showing an almost perpendicular arrangement [the dihedral angle is 72.46 (8)° in the S-enantiomer and 76.21 (8)° in the R-enantiomer]. In the crystal structure, molecules of both enantiomers show infinite helical arrangements parallel to the b axis formed by weak C—H⋯O hydrogen bonds between the phenyl ring of the benzoyl group and the carbamate carbonyl group. In case of the R-enantiomer, this helix is additionally stabilized by a bifurcated hydrogen bond between the carbonyl function of the benzoyl group towards both phenyl groups of the molecule. |
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