Reactions between protonated and neutral
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Guy Bouchoux; Nadรจge Choret
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Article
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1997
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John Wiley and Sons
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English
โ 230 KB
๐ 2 views
Ab initio molecular orbital calculations at the MP2/6-31G\*//MP2/6-31G\* + ZPE level have been performed in order to explore the reaction between CH 3 OH 2 + and CH 3 OH. The detailed mechanism of proton transfer, CH 3 OH 2 + + CH 3 OH ยฎ CH 3 OH + CH 3 OH 2 + , and of cationic nucleophilic substitut