Crystal structure of ()-5-[()-3-(4-chloro-phen-yl)-5-methyl-4,5-di-hydro-isoxazol-5-yl]-2-methyl-cyclo-hex-2-enone.

Acta Crystallogr E Crystallogr Commun

Laboratoire de Synthése Organique et de Physico-Chimie Moléculaire, Département de Chimie, Faculté des Sciences, Semlalia BP 2390, Marrakech 40001, Morocco.

Published: March 2020

The title compound, CHClNO, was prepared and isolated as a pure diastereoisomer, using column chromatography followed by a succession of fractional crystallizations. Its exact structure was fully identified H NMR and confirmed by X-ray diffraction. It is built up from a central five-membered di-hydro-isoxazole ring to which a -chloro-phenyl group and a cyclo-hex-2-enone ring are attached in the 3 and 5 positions. The cyclo-hex-2-one and isoxazoline rings each exhibit an envelope conformation. The crystal packing features C-H⋯O, C-H⋯N and C-H⋯π inter-actions, which generate a three-dimensional network.

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http://www.ncbi.nlm.nih.gov/pmc/articles/PMC7057358PMC
http://dx.doi.org/10.1107/S2056989020001991DOI Listing

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