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- W1983421430 abstract "Using semiempirical and ab initio procedures, the most stable conformations of meso- and rac-bioxirane and of some substituted 1,2:3,4-diepoxides were calculated. For threo-diepoxides (having the same relative configurations as rac-bioxirane, 3), two stable conformations with CCCC dihedral angles of ca. 90 and ca. 270° were found. For erythro-diepoxides (derivatives of meso-bioxirane, 4) the calculations suggest three preferred conformations with corresponding dihedral CCCC angles of ca. 90°, ca. 180°, and ca. 270°. The calculations are in fair agreement with the experimental data available for the unsubstituted compounds 3 and 4." @default.
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- W1983421430 date "2010-08-21" @default.
- W1983421430 modified "2023-10-14" @default.
- W1983421430 title "ChemInform Abstract: Conformational Analysis of 1,2:3,4-Diepoxides: ab initio and Semiempirical Molecular-Orbital Calculations." @default.
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- W1983421430 doi "https://doi.org/10.1002/chin.199247036" @default.
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