Startseite Lebenswissenschaften Syntheses, geometry optimization, and electronic structure of N-and C-substituted benzonaphthyridines
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Syntheses, geometry optimization, and electronic structure of N-and C-substituted benzonaphthyridines

  • M. Deska EMAIL logo und W. Śliwa
Veröffentlicht/Copyright: 1. Februar 2006
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Abstract

Synthesis of N-and C-substituted derivatives of benzo[h][1,6]naphthyridine, bearing 2-hydroxyethyl group has been made by quaternization reaction and by condensation of corresponding methylbenzonaphthyridines with formaldehyde. For six derivatives of isomeric benzo[c][1,5]-, benzo[h][1,6]-, and benzo[f][1,7]naphthyridines the 13C NMR spectra are discussed.

For ten compounds the geometry was optimized with the AM1 and, in one case also with the ab initio 6–31G method; their effective charge values have also been calculated.

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Published Online: 2006-2-1
Published in Print: 2006-2-1

© 2006 Institute of Chemistry, Slovak Academy of Sciences

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