Crystal structure, DFT study and Hirshfeld surface analysis of 1-nonyl-2,3-di­hydro-1H-indole-2,3-dione

In the title mol­ecule, C(17)H(23)NO(2), the di­hydro­indole portion is planar (r.m.s. deviation = 0.0157 Å) and the nonyl substituent is in an ‘extended’ conformation. In the crystal, the nonyl chains inter­calate and the di­hydro­indole­dione units are associated through C—H⋯O hydrogen bonds to fo...

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Detalles Bibliográficos
Autores principales: Rayni, Ibtissam, El Bakri, Youness, Lai, Chin-Hung, Sebhaoui, Jihad, Essassi, El Mokhtar, Mague, Joel T.
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/PMC6690466/
https://www.ncbi.nlm.nih.gov/pubmed/31417780
http://dx.doi.org/10.1107/S2056989019009691
Descripción
Sumario:In the title mol­ecule, C(17)H(23)NO(2), the di­hydro­indole portion is planar (r.m.s. deviation = 0.0157 Å) and the nonyl substituent is in an ‘extended’ conformation. In the crystal, the nonyl chains inter­calate and the di­hydro­indole­dione units are associated through C—H⋯O hydrogen bonds to form micellar blocks. Based on the Hirshfeld surface analysis, the most important inter­molecular inter­action is the H⋯H inter­action.

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