OSU Navigation Bar

The Ohio State University University Libraries Knowledge Bank

The Knowledge Bank is scheduled for regular maintenance on Sunday, April 20th, 8:00 am to 12:00 pm EDT. During this time users will not be able to register, login, or submit content.

ELECTONIC STRUCTURE OF STRAINED HETEROCYCLIC SYSTEMS. QUINOLINE DERIVATIVES

Please use this identifier to cite or link to this item: http://hdl.handle.net/1811/11562

Show full item record

Files Size Format View
1981-MH-10.jpg 59.58Kb JPEG image Thumbnail of ELECTONIC STRUCTURE OF STRAINED HETEROCYCLIC SYSTEMS. QUINOLINE DERIVATIVES

Title: ELECTONIC STRUCTURE OF STRAINED HETEROCYCLIC SYSTEMS. QUINOLINE DERIVATIVES
Creators: Moomaw, William R.; Kleier, D. A.; Markgraf, J. Hodge
Issue Date: 1981
Abstract: Electronic structure calculations are reported for quinoline, 2,3-dimiethylquinoline, cyclobuta-B-quinoline, cyclopenta-B-quinoline and cyclobuta-G-quinoline, The fused rings perturb the calculated ionization potentials of the quinoline moiety. Analysis of the electronic wave function in terms of localized molecular orbitals elucidates the nature of these perturbations. Particular attention is paid to the influence of the fused ring on rehybridization of the nitrogen lone pair. The calculated ionization potentials will be correlated with experimentally measured ionization potentials (form PES spectra) and with measured basicities.
URI: http://hdl.handle.net/1811/11562
Other Identifiers: 1981-MH-10
Bookmark and Share