DUGiDocsMaximum aromaticity as a guiding principle for the most suitable hosting cages in endohedral metallofullerenes
dc.contributor.author
dc.date.accessioned
2015-03-25T11:15:31Z
dc.date.available
2015-03-25T11:15:31Z
dc.date.issued
2013
dc.identifier.issn
1433-7851
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dc.description
Aquest mateix article està publicat a l'edició alemanya d''Angewandte Chemie' (ISSN 0044-8249, EISSN 1521-3757), 2013, vol.125, núm. 35, p. 9445–9448. DOI http://dx.doi.org/10.1002/ange.201303636
dc.description.abstract
Encapsulating! The encapsulation of metal clusters in endohedral metallofullerenes takes place in cages that, in most cases, are far from being the most stable isomer in the corresponding hollow fullerenes. In contrast to previous proposals, new results indicate that it is the maximum aromaticity criterion that determines the most suitable hosting cages
dc.description.sponsorship
We are grateful for financial support from the Spanish MICINN (CTQ2011-23156/BQU and CTQ2011-25086/BQU), the Catalan DIUE (2009SGR637, 2009SGR528, and XRQTC), the FEDER fund (UNGI08-4E-003). M.G.-B. thanks the Spanish MECD for a PhD fellowship (AP2010-2517) and S.O. thanks the European Community for a postdoctoral fellowship (PIOF-GA-2009-252856). Excellent service by the CESCA and BSC-CNS is acknowledged. M. Sola thanks the Catalan DIUE for the ICREA Academia 2009 Award
dc.format.mimetype
application/pdf
dc.language.iso
eng
dc.publisher
Wiley-VCH Verlag
dc.relation
info:eu-repo/grantAgreement/MICINN//CTQ2011-23156/ES/AVANCES EN CATALISIS Y AROMATICIDAD/
info:eu-repo/grantAgreement/MICINN//CTQ2011-25086/ES/MODELIZACION MULTIESCALAR EN (BIO)QUIMICA/
AGAUR/2009-2014/2009 SGR-637
AGAUR/2009-2014/2009 SGR-528
dc.relation.isformatof
Reproducció digital del document publicat a: http://dx.doi.org/10.1002/anie.201303636
dc.relation.ispartof
© Angewandte Chemie - International Edition, 2013, vol. 52, p. 9275-9278
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Articles publicats (D-Q)
dc.rights
Tots els drets reservats
dc.subject
dc.title
Maximum aromaticity as a guiding principle for the most suitable hosting cages in endohedral metallofullerenes
dc.type
info:eu-repo/semantics/article
dc.rights.accessRights
info:eu-repo/semantics/embargoedAccess
dc.embargo.terms
Cap
dc.date.embargoEndDate
info:eu-repo/date/embargoEnd/2026-01-01
dc.relation.projectID
info:eu-repo/grantAgreement/EC/FP7/252856/EU/Enzyme Design of Medical Interest/MEDENZYMEDESIGN
dc.type.version
info:eu-repo/semantics/publishedVersion
dc.identifier.doi
dc.identifier.idgrec
018131
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dc.relation.FundingProgramme
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dc.identifier.eissn
1521-3773