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Original Articles

FRONTIER-ORBITAL RING CURRENTS AND THE ANNULENE ANALOGY

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Pages 353-366 | Received 01 Sep 2003, Accepted 01 Jan 2004, Published online: 16 Aug 2010

REFERENCES

  • Minkin , V. I. , Glukhovtsev , M. N. and Simkin , B. Y. 1994 . Aromaticity and Antiaromaticity: Electronic and Structural Aspects , New York : J. Wiley and Sons .
  • von Ragué Schleyer , P. and Jiao , H.-J. 1996 . What Is Aromaticity? . Pure and Applied Chemistry , 68 : 209 – 218 .
  • Longuet-Higgins , H. C. 1967 . “ Paramagnetic Ring Currents in the [4n]-Annulenes ” . In Aromaticity , 109 – 110 . London : The Chemical Society . Special Publication no. 21
  • Dauben , H. J. , Wilson , J. D. and Laity , J. L. 1971 . “ Diamagnetic Susceptibility Exaltation as a Criterion of Aromaticity ” . In Nonbenzenoid Aromatics , Edited by: Snyder , J. P. 167 – 206 . New York : Academic Press . in
  • Pople , J. A. 1956 . Proton Magnetic Resonance of Hydrocarbons . Journal of Chemical Physics , 24 : 1111
  • von Ragué Schleyer , P. , Maerker , C. , Dransfeld , A. , Jiao , H. and van Eikema Hommes , N. J. R. 1996 . Nucleus-Independent Chemical Shifts (NICS): A Simple and Efficient Aromaticity Probe . Journal of the American Chemical Society , 118 : 6317 – 6318 .
  • Keith , T. A. and Bader , R. F. W. 1993 . Calculation of Magnetic Response Properties Using a Continuous Set of Gauge Transformations . Chemical Physics Letters , 210 : 223 – 231 . http://dx.doi.org/10.1016/0009-2614%2893%2989127-4
  • Coriani , S. , Lazzeretti , P. , Malagoli , M. and Zanasi , R. 1994 . On the CHF Calculations of Second-Order Magnetic Properties Using the Method of Continuous Transformation of Origin of the Current Density . Theoretica Chimica Acta , 89 : 181 – 192 .
  • Steiner , E. and Fowler , P. W. 2001 . Patterns of Ring Currents in Conjugated Molecules: A Few-Electron Model Based on Orbital Contributions . Journal of Physical Chemistry , A105 : 9553 – 9562 .
  • Steiner , E. and Fowler , P. W. 2001 . Four- and Two-Electron Rules for Diatropic and Paratropic Ring Currents in Monocyclic π Systems . Chemical Communications , : 2220 – 2221 .
  • Lazzeretti , P. and Zanasi , R. 1980 . SYSMO package , University of Modena . Some additional routines for evaluation, plotting, and localization of current density were written in Exeter (E. Steiner, P. W. Fowler, R. W. A. Havenith)
  • Steiner , E. , Fowler , P. W. and Havenith , R. W. A. 2002 . Current Densities of Localised and Delocalised Electrons in Molecules . Journal of Physical Chemistry , A106 : 7048 – 7056 .
  • Soncini , A. , Havenith , R. W. A. , Fowler , P. W. , Jenneskens , L. W. and Steiner , E. 2002 . Control of the Diatropic π Ring Current in Strained Benzenes: Effects of Annelation with Cyclopropa-, Cyclobuta- and Cyclobutadieno-Clamping Groups . Journal of Organic Chemistry , 67 : 4753 – 4758 .
  • Havenith , R. W. A. , Rassat , A. and Fowler , P. W. 2002 . Selection Rules for Ring Currents in Radial π Systems: Trannulene Substructures in Hydrogenated Fullerene Cages . Journal of the Chemical Society Perkin , 2 : 723 – 727 .
  • Burley , G. A. , Fowler , P. W. , Soncini , A. , Sandall , J. P. B. and Taylor , R. 2004 . A Diatropic Ring Current in a Fluorofullerene Trannulene . Chemical Communications , : 3042 – 3043 .
  • Binsch , G. , Heilbronner , E. and Murrell , J. N. 1966 . The Theory of Double Bond Fixation in Conjugated Hydrocarbons . Molecular Physics , 11 : 305 – 320 .
  • Steiner , E. , Fowler , P. W. and Jenneskens , L. W. 2001 . Counter-Rotating Ring Currents in Coronene and Corannulene . Angewandte Chemie International Edition , 40 : 362 – 366 .
  • Katritzky , A. R. 1999 . The Continuing Magic of Benzotriazole: An Overview of Some Recent Advances in Synthetic Methodology . Journal of Heterocyclic Chemistry , 36 : 1501 – 1522 .
  • Havenith , R. W. A. , Lugli , F. , Fowler , P. W. and Steiner , E. 2002 . Ring Current Patterns in Annelated Bicyclic Polyenes . Journal of Physical Chemistry , A106 : 5703 – 5708 .
  • Steiner , E. and Fowler , P. W. 1996 . Ring Currents in Aromatic Hydrocarbons . International Journal of Quantum Chemistry , 60 : 609 – 616 .
  • Steiner , E. and Fowler , P. W. 2002 . Ring Currents in the Porphyrins: A Four-Orbital Model . PhysChemPhys , 3 : 114 – 116 .
  • Steiner , E. , Fowler , P. W. and Havenith , R. W. A. 2002 . Ring Current and Electron Delocalisation in an All-Metal Cluster, Al4 2− . Chemical Physics Letters , 359 : 530 – 536 .

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