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Inductive or Field Substituent Effect? Quantum Chemical Modeling of Interactions in 1-Monosubstituted Bicyclooctane Derivatives

[Image: see text] Inductive substituent constants were obtained for systems lacking the resonance effect. The application of the charge of the substituent active region concept to study the substituent effect in 1-X-substituted bicyclooctane derivatives (B3LYP/6-311++G** calculations, X = NMe(2), NH...

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Detalles Bibliográficos
Autores principales: Szatylowicz, Halina, Siodła, Tomasz, 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/PMC6641047/
https://www.ncbi.nlm.nih.gov/pubmed/31457538
http://dx.doi.org/10.1021/acsomega.7b00390