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Ground states of conjugated molecules. XV. bond localization and resonance energies in compounds containing Nitrogen or Oxygen

Dewar, M. J. S.; Harget, A. J.; Trinajstić, Nenad (1969) Ground states of conjugated molecules. XV. bond localization and resonance energies in compounds containing Nitrogen or Oxygen. Journal of the American Chemical Society, 91 (23). pp. 6321-6325. ISSN 0002-7863

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Abstract

The heats of formation of, and bond lengths in, a number of classical conjugated molecules containing nitrogen or oxygen have been calculated by the method of part XII of this series. The results imply that the bonds in compounds of this type can be regarded as localized. Using the bond energies deduced in this way, resonance energies are calculated for a number of aromatic, and potentially aromatic, compounds containing nitrogen or oxygen.

Item Type: Article
Uncontrolled Keywords: conjugated molecules
Subjects: NATURAL SCIENCES > Chemistry
Divisions: Division of Physical Chemistry
Depositing User: Marina Mayer
Date Deposited: 02 Oct 2015 10:02
Last Modified: 02 Oct 2015 10:02
URI: http://fulir.irb.hr/id/eprint/2134
DOI: 10.1021/ja01051a023

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