Guidelines for Tuning the Excited State Hückel-Baird Hybrid Aromatic Character of Pro-Aromatic Quinoidal Compounds*.

Escayola, Sílvia; Tonnelé, Claire; Matito, Eduard; Poater, Albert; Ottosson, Henrik; Solà, Miquel; Casanova, David

Escayola, Sílvia; Tonnelé, Claire; Matito, Eduard; Poater, Albert; Ottosson, Henrik; Solà, Miquel; Casanova, David.

Afiliação

Escayola S; Institute of Computational Chemistry and Catalysis and Department of Chemistry, University of Girona, C/ M. Aurèlia Capmany, 69, 17003, Girona, Catalonia, Spain.
Tonnelé C; Donostia International Physics Center (DIPC), Donostia, Euskadi, Spain.
Matito E; Donostia International Physics Center (DIPC), Donostia, Euskadi, Spain.
Poater A; Donostia International Physics Center (DIPC), Donostia, Euskadi, Spain.
Ottosson H; Ikerbasque Foundation for Science, 48009, Bilbao, Euskadi, Spain.
Solà M; Institute of Computational Chemistry and Catalysis and Department of Chemistry, University of Girona, C/ M. Aurèlia Capmany, 69, 17003, Girona, Catalonia, Spain.
Casanova D; Department of Chemistry-Ångström Laboratory, Uppsala University, 75120, Uppsala, Sweden.

Angew Chem Int Ed Engl ; 60(18): 10255-10265, 2021 Apr 26.

Article em En | MEDLINE | ID: mdl-33569836

Palavras-chave

Baird aromaticity; Hückel aromaticity; conjugated molecules; excited states; triplet state

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Texto completo: 1 Base de dados: MEDLINE Tipo de estudo: Guideline Idioma: En Revista: Angew Chem Int Ed Engl Ano de publicação: 2021 Tipo de documento: Article País de afiliação: Espanha

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