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Tuning the Intramolecular Chemiexcitation of Neutral Dioxetanones by Interaction with Ionic Species

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 external stimuli tune the...

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Detalles Bibliográficos
Autores principales: Magalhães, Carla M., Esteves da Silva, Joaquim C. G., Pinto da Silva, Luís
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9228516/
https://www.ncbi.nlm.nih.gov/pubmed/35744984
http://dx.doi.org/10.3390/molecules27123861