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Diradicalar Character and Ring Stability of Mesoionic Heterocyclic Oxazoles and Thiazoles by Ab Initio Mono and Multi-Reference Methods

Mesoionics are neutral compounds that cannot be represented by a fully covalent or purely ionic structure. Among the possible mesomeric structures of these compounds are the diradical electronic configurations. Theoretical and experimental studies indicate that some mesoionic rings are unstable, whi...

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Dettagli Bibliografici
Pubblicato in:Molecules
Autori principali: da Silva Filho, Antonio João, da Cruz Dantas, Lucinêz, de Santana, Otávio Luís
Natura: Artigo
Lingua:Inglês
Pubblicazione: MDPI 2020
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Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC7582729/
https://ncbi.nlm.nih.gov/pubmed/33023193
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules25194524
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