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Crystal structure and Hirshfeld surface analysis of isopropyl 4-[2-fluoro-5-(tri-fluoro-meth-yl)phen-yl]-2,6,6-trimethyl-5-oxo-1,4,5,6,7,8-hexa-hydro-quinoline-3-carboxyl-ate.

Sema Öztürk YıldırımMehmet AkkurtGökalp ÇetinRahime ŞimşekRaymond John ButcherAjaya Bhattarai
Published in: Acta crystallographica. Section E, Crystallographic communications (2023)
In the title compound, C 23 H 25 F 4 NO 3 , the 1,4-di-hydro-pyridine ring adopts a distorted boat conformation, while the cyclo-hexene ring is almost showing a half-chair conformation. In the crystal, inter-molecular N-H⋯O hydrogen bonds connect the mol-ecules into chains with graph-set motif C (6) parallel to the a -axis. These chains are linked together by C-H⋯O and C-H⋯F inter-actions, forming a three-dimensional network. In addition, C-H⋯π inter-actions link the mol-ecules into layers parallel to the (100) plane. A Hirshfeld surface analysis was performed to further investigate the inter-molecular inter-actions.
Keyphrases
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