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Crystal structure, Hirshfeld surface analysis, interaction energy and energy framework calculations, as well as density functional theory (DFT) computation, of methyl 2-oxo-1-(prop-2-ynyl)-1,2-dihydroquinoline-4-carboxylate

In the title molecule, C(14)H(11)NO(3), the dihydroquinoline core deviates slightly from planarity, indicated by the dihedral angle of 1.07 (3)° between the two six-membered rings. In the crystal, layers of molecules almost parallel to the bc plane are formed by C—H⋯O hydrogen bonds. These are...

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Detalles Bibliográficos
Autores principales:	El-Mrabet, Ayoub, Haoudi, Amal, Dalbouha, Samira, Skalli, Mohamed Khalid, Hökelek, Tuncer, Capet, Frederic, Kandri Rodi, Youssef, Mazzah, Ahmed, Sebbar, Nada Kheira
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	International Union of Crystallography 2023
Materias:	Research Communications
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10561202/ https://www.ncbi.nlm.nih.gov/pubmed/37817963 http://dx.doi.org/10.1107/S2056989023007557

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