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PROTONATION OF THE AMIDE GROUP: II. DICYCLOHEXYLUREA-O 18

✍ Scribed by Stewart, Ross; Muenster, L. J.


Book ID
120205356
Publisher
NRC Research Press
Year
1961
Tongue
French
Weight
343 KB
Volume
39
Category
Article
ISSN
0008-4042

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N- versus O-proton affinities of the ami
✍ R. Bonaccorsi; A. Pullman; E. Scrocco; J. Tomasi πŸ“‚ Article πŸ“… 1972 πŸ› Elsevier Science 🌐 English βš– 311 KB

The electrostatic mokcular potentials arising from ab initio LCAO SCF -wavefunctions with two different gaussian basis sets are used to discuss the protonation of formamide. Oxygen pmtonation is clearly favoured. It h,as been suggested recently [l] that an approach to reactivity and in particular to