Interplay Between Anion-pi and Hydrogen Bonding Interactions

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dc.contributor.author Escudero, D.
dc.contributor.author Frontera, A.
dc.contributor.author Quiñonero, D.
dc.contributor.author Deyà, P.M.
dc.date.accessioned 2020-04-30T06:28:03Z
dc.identifier.uri http://hdl.handle.net/11201/152189
dc.description.abstract [eng] The interplay between two important noncovalent interactions involving aromatic rings is studied by means of high level ab initio calculations. They demonstrate that synergistic effects are present in complexes where anion‐π and hydrogen bonding interactions coexist. These synergistic effects have been studied using the "atoms‐in‐molecules" theory and the Molecular Interaction Potential with polarization partition scheme. The present study examines how these two interactions mutually influence each other. © 2008 Wiley Periodicals, Inc. J Comput Chem, 2009
dc.format application/pdf
dc.relation.isformatof https://doi.org/10.1002/jcc.21031
dc.relation.ispartof Journal of Computational Chemistry, 2009, vol. 30, num. 1, p. 75-82
dc.rights , 2009
dc.subject.classification 54 - Química
dc.subject.other 54 - Chemistry. Crystallography. Mineralogy
dc.title Interplay Between Anion-pi and Hydrogen Bonding Interactions
dc.type info:eu-repo/semantics/article
dc.date.updated 2020-04-30T06:28:03Z
dc.date.embargoEndDate info:eu-repo/date/embargoEnd/2026-12-31
dc.embargo 2026-12-31
dc.rights.accessRights info:eu-repo/semantics/embargoedAccess
dc.identifier.doi https://doi.org/10.1002/jcc.21031


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