Please use this identifier to cite or link to this item: http://hdl.handle.net/10553/74701
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dc.contributor.authorAzofra Mesa, Luis Miguelen_US
dc.contributor.authorElguero, Joséen_US
dc.contributor.authorAlkorta, Ibonen_US
dc.date.accessioned2020-10-13T12:46:10Z-
dc.date.available2020-10-13T12:46:10Z-
dc.date.issued2020en_US
dc.identifier.issn1463-9076en_US
dc.identifier.otherScopus-
dc.identifier.urihttp://hdl.handle.net/10553/74701-
dc.description.abstractInteranionic H-bonds (IAHBs) are unfavourable interactions in the gas phase becoming favoured when anions are in solution. Dianion dimers are also susceptible to being trapped inside the cavities of cyanostar (CS) macrocycles, and thus, the formation of 2 : 2 anion : cyanostar aggregates is mainly supported by three kinds of interactions: IAHBs between the dianions, π-π stacking between the confronted cyanostars, and the presence of an intricate network of multiple C(sp2)HO H-bonds between cyanostar ligands and the anionic moieties. An analysis of the interaction energies supported by NBO reveals a slight cooperative effect of the CSs on the IAHB stabilisation.en_US
dc.languageengen_US
dc.relation.ispartofPhysical Chemistry Chemical Physicsen_US
dc.sourcePhysical Chemistry Chemical Physics [EISSN 1463-9084], v. 22 (20), p. 11348-11353, (Mayo 2020)en_US
dc.subject2307 Química físicaen_US
dc.titleStabilisation of dianion dimers trapped inside cyanostar macrocyclesen_US
dc.typeinfo:eu-repo/semantics/Articleen_US
dc.typeArticleen_US
dc.identifier.doi10.1039/D0CP01321Hen_US
dc.identifier.scopus85085536137-
dc.contributor.authorscopusid55142490200-
dc.contributor.authorscopusid35474081900-
dc.contributor.authorscopusid7005819296-
dc.identifier.eissn1463-9084-
dc.description.lastpage11353en_US
dc.identifier.issue20-
dc.description.firstpage11348en_US
dc.relation.volume22en_US
dc.investigacionCiencias-
dc.type2Artículoen_US
dc.description.numberofpages6en_US
dc.utils.revision-
dc.date.coverdateMayo 2020en_US
dc.identifier.ulpgc-
dc.contributor.buulpgcBU-BASen_US
dc.description.sjr1,053
dc.description.jcr3,676
dc.description.sjrqQ1
dc.description.jcrqQ1
dc.description.scieSCIE
item.grantfulltextopen-
item.fulltextCon texto completo-
crisitem.author.deptGIR Fotocatálisis y espectroscopía para aplicaciones medioambientales. Unidad asociada al CSIC a través del Instituto de Ciencias de Materiales de Sevilla-
crisitem.author.deptIU de Estudios Ambientales y Recursos Naturales-
crisitem.author.orcid0000-0003-4974-1670-
crisitem.author.parentorgIU de Estudios Ambientales y Recursos Naturales-
crisitem.author.fullNameAzofra Mesa, Luis Miguel-
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