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Crystal and molecular structure of bis(8-phenylmenthyl) 2-(2-methyl-5-oxo-3-cyclohexen-1-yl)propandioate, C42H54O5· CH3CN
Authors:Dennis W. Bennett  Tasneem A. Siddiquee  Daniel T. Haworth  Subhabrata Chaudhury  William A. Donaldson
Affiliation:(1) Department of Chemistry, University of Wisconsin-Milwaukee, P. O. Box 413, Milwaukee, WI 53201-0413, USA;(2) Department of Chemistry, Marquette University, Todd Wehr Chemistry Building, P. O. Box 1881, Milwaukee, WI 53201-1881, USA
Abstract:
The X-ray crystal structure of the title compound, as crystallized from acetonitrile-water was determined. The relative stereochemistry of the cyclohexenone ring with respect to the 8-phenylmenthyl esters was determined. The title compound crystallizes in the noncentrosymmetric space group P21, with a=8.9850(10) ?, b=15.575(3) ?, c=14.478(2) ?, β=94.61(2)°, and D calc=1.118 g cm−3 for Z=2.
Keywords:2-cyclohexenone  8-phenylmenthyl esters.
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