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Is the Fluorine in Molecules Dispersive? Is Molecular Electrostatic Potential a Valid Property to Explore Fluorine-Centered Non-Covalent Interactions?

Can two sites of positive electrostatic potential localized on the outer surfaces of two halogen atoms (and especially fluorine) in different molecular domains attract each other to form a non-covalent engagement? The answer, perhaps counterintuitive, is yes as shown here using the electronic struct...

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Detalles Bibliográficos
Autores principales: Varadwaj, Arpita, Marques, Helder M., Varadwaj, Pradeep R.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6384640/
https://www.ncbi.nlm.nih.gov/pubmed/30678158
http://dx.doi.org/10.3390/molecules24030379