Interplay Between Planar and Spherical Aromaticity: Shielding Cone Behavior in Dual Planar-Planar, Planar-Spherical and Spherical-Spherical Aromatics

dc.contributor.author	Muñoz-Castro A.
dc.date.accessioned	2020-09-02T22:24:08Z
dc.date.available	2020-09-02T22:24:08Z
dc.date.issued	2020
dc.identifier	10.1002/cphc.202000322
dc.identifier.citation	21, 13, 1384-1387
dc.identifier.issn	14394235
dc.identifier.uri	https://hdl.handle.net/20.500.12728/5509
dc.description	The shielding cone concept is one of the most characteristic aspects of planar aromatic species. Herein, we explored how two neighbor aromatic moieties behave as dual planar-planar, planar-spherical, and spherical-spherical species given by biphenyl, [PhCB11H11]−, and [CB11H11]22−, respectively. Our results show two separate aromatic regimes given by Clar's sextet and spherical aromatic states, with independent shielding cones sharing shielding regions of moderate strength, which can be extended for networks involving multiple independent aromatic states. © 2020 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim
dc.language.iso	en
dc.publisher	Wiley-VCH Verlag
dc.subject	benzene
dc.subject	carborane
dc.subject	NICS
dc.subject	shielding cone
dc.subject	spherical aromaticity
dc.subject	Aromatic compounds
dc.subject	Aromatization
dc.subject	Shielding
dc.subject	Aromatic moieties
dc.subject	Aromatic species
dc.subject	Aromaticities
dc.subject	Dual-planar
dc.subject	Spheres
dc.title	Interplay Between Planar and Spherical Aromaticity: Shielding Cone Behavior in Dual Planar-Planar, Planar-Spherical and Spherical-Spherical Aromatics
dc.type	Article

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