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The Molecular Orbital Theory of Chemical Valency. XI. Bond Energies, Resonance Energies and Triplet State Energies

โœ Scribed by Hall, G. G.

Book ID
120145479
Publisher
The Royal Society
Year
1952
Tongue
English
Weight
513 KB
Volume
213
Category
Article
ISSN
0962-8444

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Ab initio 3CF and SCP Cl caJcuJatjons ~4th Zhe STO-3C basis set have been pcrformcd in this study of the effect of jntramolccubr hydrogen bonding on n orbital cncrgjcs and n -r I?\* transition encrgiw in ,&hydroxyacrofcin. In the hydrogen bonded C, form, the n orbital is stabWed and the n -+ s\* tnn