Synthesis, crystal structure and Hirshfeld surface analysis of 1-[(1-octyl-1H-1,2,3-triazol-4-yl)methyl]-3-phenyl-1,2-dihydroquinoxalin-2(1H)-one
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Published:2024-08-09
Issue:9
Volume:80
Page:936-941
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ISSN:2056-9890
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Container-title:Acta Crystallographica Section E Crystallographic Communications
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language:
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Short-container-title:Acta Crystallogr E Cryst Commun
Author:
Abad Nadeem, Mague Joel T.ORCID, Kalonji Mubengayi Camille, Alsubari Abdulsalam, Essassi El Mokhtar, Ramli YoussefORCID
Abstract
In the title molecule, C25H29N5O, the dihydroquinoxaline unit is not quite planar (r.m.s. deviation = 0.030 Å) as there is a dihedral angle of 2.69 (3)° between the mean planes of the constituent rings and the molecule adopts a hairpin conformation. In the crystal, the polar portions of the molecules are associated through C—H...O and C—H...N hydrogen bonds and C—H...π(ring) and C=O...π(ring) interactions, forming thick layers parallel to the bc plane and with the n-octyl groups on the outside surfaces.
Publisher
International Union of Crystallography (IUCr)
Reference38 articles.
1. Abad, N., Al-Ostoot, F. H., Ashraf, S., Chkirate, K., Aljohani, M. S., Alharbi, H. Y., Buhlak, S., El Hafi, M., Van Meervelt, L., Al-Maswari, B. M., Essassi, El M. & Ramli, Y. (2023a). Heliyon 9, e21312. 2. Crystal structure, Hirshfeld surface analysis and density functional theory study of 1-nonyl-3-phenylquinoxalin-2-one 3. Abad, N., El Bakri, Y., Sebhaoui, J., Ramli, Y., Essassi, E. M. & Mague, J. T. (2018a). IUCrData, 3, x180519. 4. Abad, N., El Bakri, Y., Sebhaoui, J., Ramli, Y., Essassi, E. M. & Mague, J. T. (2018c). IUCrData, 3, x180610. 5. Crystal structure and Hirshfeld surface analysis of 2-(2-oxo-3-phenyl-1,2,3,8a-tetrahydroquinoxalin-1-yl)ethyl acetate
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