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Crystal structure, Hirshfeld surface analysis and interaction energy and DFT studies of 1-methyl-3-(prop-2-yn-1-yl)-2,3-dihydro-1H-1,3-benzodiazol-2-one

In the title molecule, C(11)H(10)N(2)O, the dihydrobenzimidazol-2-one moiety is essentially planar, with the prop-2-yn-1-yl substituent rotated well out of this plane. In the crystal, C—H(Mthy)⋯π(ring) interactions and C—H(Prop)⋯O(Dhyr) (Mthy = methyl, Prop = prop-2-yn-1-yl and Dhyr = dihydro)...

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Detalles Bibliográficos
Autores principales:	Saber, Asmaa, Srhir, Mohamed, Hökelek, Tuncer, Mague, Joel T., Hamou Ahabchane, Noureddine, Sebbar, Nada Kheira, Essassi, El Mokhtar
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	International Union of Crystallography 2019
Materias:	Research Communications
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6895944/ https://www.ncbi.nlm.nih.gov/pubmed/31871762 http://dx.doi.org/10.1107/S2056989019015779

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