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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...

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Detalles Bibliográficos
Autores principales: Martens, Viktor, Görls, Helmar, Imhof, Wolfgang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2021
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
Descripción
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.