Clusters of Hydroxyl-Functionalized Cations Stabilized by Cooperative Hydrogen Bonds: The Role of Polarizability and Alkyl Chain Length

We explore quantum chemical calculations for studying clusters of hydroxyl-functionalized cations kinetically stabilized by hydrogen bonding despite strongly repulsive electrostatic forces. In a comprehensive study, we calculate clusters of ammonium, piperidinium, pyrrolidinium, imidazolium, pyridin...

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Detalles Bibliográficos
Autores principales: Philipp, Jule K., Ludwig, Ralf
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7662246/
https://www.ncbi.nlm.nih.gov/pubmed/33121087
http://dx.doi.org/10.3390/molecules25214972

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7662246/
https://www.ncbi.nlm.nih.gov/pubmed/33121087
http://dx.doi.org/10.3390/molecules25214972

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