Toward the Physical Interpretation of Inductive and Resonance Substituent Effects and Reexamination Based on Quantum Chemical Modeling

[Image: see text] An application of a charge of the substituent active region concept to 1-Y,4-X-disubstituted derivatives of bicyclo[2.2.2]octane (BCO) [where Y = NO(2), COOH, OH, and NH(2) and X = NMe(2), NH(2), OH, OMe, Me, H, F, Cl, CF(3), CN, CHO, COMe, CONH(2), COOH, NO(2), and NO] provides a...

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Detalles Bibliográficos
Autores principales: Szatylowicz, Halina, Jezuita, Anna, Siodła, Tomasz, Varaksin, Konstantin S., Domanski, Mateusz A., Ejsmont, Krzysztof, Krygowski, Tadeusz M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2017
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6645133/
https://www.ncbi.nlm.nih.gov/pubmed/31457295
http://dx.doi.org/10.1021/acsomega.7b01043