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- W1972414976 abstract "Abstract Ab initio molecular orbital calculations were carried out to determine the activation energy of the methane loss from the dimethyloxonium cation. At the approximate MP4SDTQ/6-311 + +G(2df,2p) + ZPE level based on MP2/6-31G(d,p)-geometries, the energy barrier is calculated to be 267 ± 15 kJ mol−1." @default.
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- W1972414976 date "1993-04-01" @default.
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- W1972414976 title "On the energy barrier for 1,2-elimination of methane from the dimethyloxonium cation" @default.
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- W1972414976 doi "https://doi.org/10.1016/0168-1176(93)80099-z" @default.
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