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Published in 2022 at "Molecules"
DOI: 10.3390/molecules27123861
Abstract: The intramolecular chemiexcitation of high-energy peroxide intermediates, such as dioxetanones, is an essential step in different chemi- and bioluminescent reactions. Here, we employed the Time-Dependent Density Functional Theory (TD-DFT) methodology to evaluate if and how…
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Keywords:
ionic species;
neutral dioxetanones;
tuning intramolecular;
intramolecular chemiexcitation ... See more keywords