On the cation–π capabilities of small all sp2-carbon host structures. Evaluation of [6.8]3cyclacene from relativistic DFT calculations

dc.creatorOrtolan A.O.
dc.creatorCharistos N.D.
dc.creatorGuajardo-Maturana R.
dc.creatorUlloa C.O.
dc.creatorCaramori G.F.
dc.creatorParreira R.L.T.
dc.creatorMuñoz-Castro A.
dc.date.accessioned2020-09-02T22:25:10Z
dc.date.accessioned2022-11-08T20:21:35Z
dc.date.available2020-09-02T22:25:10Z
dc.date.available2022-11-08T20:21:35Z
dc.date.created2020-09-02T22:25:10Z
dc.date.issued2019
dc.identifier119, 4, -
dc.identifier00207608
dc.identifierhttps://hdl.handle.net/20.500.12728/5676
dc.identifier.urihttps://repositorioslatinoamericanos.uchile.cl/handle/2250/5144084
dc.languageen
dc.publisherJohn Wiley and Sons Inc.
dc.subjectbonding
dc.subjectcation–π
dc.subjectDFT
dc.subjectEDA-NOCV
dc.subjecthost
dc.subjectBonding
dc.subjectCharge transfer
dc.subjectChemical bonds
dc.subjectNanobelts
dc.subjectYarn
dc.subjectBonding characteristics
dc.subjectCarbon backbone
dc.subjectCoordination modes
dc.subjectEDA-NOCV
dc.subjecthost
dc.subjectMetal coordination
dc.subjectPi interactions
dc.subjectProtein structures
dc.subjectPositive ions
dc.titleOn the cation–π capabilities of small all sp2-carbon host structures. Evaluation of [6.8]3cyclacene from relativistic DFT calculations
dc.typeArticle


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