ListarQF - Artículos por tema "Estructura química"

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Tuning the Diradical Character of Indolocarbazoles: Impact of Structural Isomerism and Substitution Position

Badía-Domínguez, María Irene; Canola, Sofía; Hernández-Jolín, Víctor; López-Navarrete, Juan Teodomiro; Sancho-García, Juan C.; Negri, Fabrizia; Ruíz-Delgado, María del Carmen[et al.] (American Chemical Society, 2022-06-23)

In this study, a set of 10 positional indolocarbazole (ICz) isomers substituted with dicyanomethylene groups connected via para or meta positions are computationally investigated with the aim of exploring the efficiency ...