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  The 2(N+1)2 rule for spherical aromaticity: further validation

Chen, Z., Jiao, H., Hirsch, A., & Thiel, W. (2001). The 2(N+1)2 rule for spherical aromaticity: further validation. Journal of Molecular Modeling, 7(5), 161-163. doi:10.1007/s008940100021.

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Item Permalink: https://hdl.handle.net/11858/00-001M-0000-0024-0816-C Version Permalink: https://hdl.handle.net/11858/00-001M-0000-0024-0817-A
Genre: Journal Article

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 Creators:
Chen, Zhongfang1, 2, Author
Jiao, Haijun1, 3, Author
Hirsch, Andreas1, Author
Thiel, Walter2, Author           
Affiliations:
1Institut für Organische Chemie, Universität Erlangen-Nürnberg, Henkestrasse 42, 91054 Erlangen, Germany, ou_persistent22              
2Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society, ou_1445590              
3Laboratoire de Chimie du Solide et Inorganique Moléculaire, UMR CNRS 6511, Université de Rennes 1, 35042 Rennes Cedex, France, ou_persistent22              

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Free keywords: Spherical aromaticity · NICS · 2(N+1)2 rule · Fullerenes · Hydrogen clusters
 Abstract: Maximum spherical aromaticity occurs in icosahedral fullerenes when the valence π-shells are completely filled with 2(N+1)2 electrons. Ab initio calculations of nucleus-independent chemical shifts show that this rule can also be applied to less symmetrical small fullerenes and hydrogen clusters.

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Language(s): eng - English
 Dates: 2001-01-242001-03-222001-05-312001-05
 Publication Status: Issued
 Pages: 3
 Publishing info: -
 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1007/s008940100021
 Degree: -

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Title: Journal of Molecular Modeling
  Other : J. Mol. Model.
Source Genre: Journal
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Publ. Info: Berlin : Springer
Pages: 3 Volume / Issue: 7 (5) Sequence Number: - Start / End Page: 161 - 163 Identifier: ISSN: 1610-2940
CoNE: https://pure.mpg.de/cone/journals/resource/954925573936