Electronic structure of the 6+6 dimer of tropone

I. D. Reingold, J. A. Kowaiski, G. C. Cummings, R. Gleiter, H. Lange, S. Lovell, B. Kahr, K. Aflatooni, P. D. Burrow, G. A. Gallup

Research output: Contribution to journalArticlepeer-review


Photoelectron and electron transmission (ET) spectroscopy were used to determine the ionization potentials and vertical electron attachment energies, respectively, of the 6+6 dimer of tropone. These measurements are combined with electronic structure calculations to provide insight into the extent of the coupling between the two cycloheptadienone ring systems. The ground state anion is predicted to be slightly stable as a consequence of the interaction between the π* orbital s of the C=O and butadiene groups.

Original languageEnglish (US)
Pages (from-to)642-646
Number of pages5
JournalJournal of Physical Organic Chemistry
Issue number10
StatePublished - Oct 2006


  • Electron transmission spectroscopy
  • Orbital coupling
  • Photoelectron spectroscopy
  • Tropone

ASJC Scopus subject areas

  • Physical and Theoretical Chemistry
  • Organic Chemistry


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