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Published in 2020 at "Molecules"
DOI: 10.3390/molecules25122803
Abstract: The mechanism of reactions of silatranes and germatranes, and their bicyclic and monocyclic analogues with one molecule of methanol or ethanol, was studied at the Density Functional Theory (DFT) B3PW91/6-311++G(df,p) level of theory. Reactions of…
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Keywords:
methanol ethanol;
mechanism reactions;
dft;
reactions substituted ... See more keywords