Mechanism for the interconversion between cis and trans difluorocyclopropanes A theoretical study

Ab-initio calculations were performed at the D95V** level of theory to determine the equilibrium geometries of difluorocyclopropane (DFCP) with the two fluorines on different carbon atoms. The calculated energy difference between the cis and trans isomers is in excellent agreement with the accepted...

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Author: Ricardo Jose Alvarado Noguera
Degree Work Type: Dissertation (Ph.D.)
Institution: Villanova University
Format: Degree Work
Language: English
Published: 1992
Subjects:
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