Issue 29, 2006
From the journal:

Physical Chemistry Chemical Physics

The origin of the ring current in the all-metal aromatic, Al42−

Remco W. A. Havenitha  and  Patrick W. Fowler*b  

* Corresponding authors

a Theoretical Chemistry Group, Utrecht University, Padualaan 8, 3584 CH Utrecht, The Netherlands

b Department of Chemistry, University of Sheffield, Sheffield, UK

Abstract

Apparent contradictions between ipsocentric, Nucleus-Independent Chemical Shift (NICS) and Gauge-Including Magnetically Induced Current (GIMIC) evaluations of ring current aromaticity in Al42− are resolved in favour of the description of this all-metal system as σ aromatic on the magnetic criterion.

Graphical abstract: The origin of the ring current in the all-metal aromatic, Al42−

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Article information

DOI
https://doi.org/10.1039/B607410C
Article type
Communication
Submitted
25 May 2006
Accepted
08 Jun 2006
First published
16 Jun 2006

Phys. Chem. Chem. Phys., 2006,8, 3383-3386

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The origin of the ring current in the all-metal aromatic, Al42−

R. W. A. Havenith and P. W. Fowler, Phys. Chem. Chem. Phys., 2006, 8, 3383 DOI: 10.1039/B607410C

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