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Molecular mechanics studies on isogermacrone
Authors:P.M. Ivanov  N.V. Bozhkov  A.S. Orahovats
Affiliation:Institute of Organic Chemistry, Bulgarian Academy of Sciences, Sofia 1113 Bulgaria
Abstract:Molecular mechanics studies on the distribution of conformers with parallel and crossed double bonds at C-2 and C-7 of the ten-membered ring ketone isogermacrone led to a 6.7 kJ mol?1 difference between the two most stable conformers the barrier between them being approximately 66.9 kJ mol?1.
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