Navegação por Assunto "Electronic effect"
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Computational study of electronic effects from β-substituents on the tautomerism of naphthazarin derivatives
(2017) [Artigo de periódico]In this work, semi-empirical AM1 and DFT B3LYP/6-31G** calculations were applied in the study of the interconversion among tautomers of several naphthazarin and 5-amino-8-hydroxy-1,4-naphthoquinone β-substituted derivatives ...