Ab initio studies of structural features not easily amenable to experiment : Part 24. Molecular structures and conformational analyses of the methyl esters of formic acid, acetic acid and alanine |
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Authors: | C Van Alsenoy J N Scarsdale Lothar Schfer |
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Institution: | Department of Chemistry, University of Arkansas, Fayetteville, AR 72701 U.S.A. |
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Abstract: | The molecular structures of four conformations of methyl formate, of two conformations, each, of methyl acetate and methyl alanate have been determined by ab initio force relaxation on the 4-21G level. Relative stabilities and some selected structural aspects are discussed. |
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