LCAO–MO studies on hydrogen bonding: The interaction between carbonyl and hydroxyl groups
✍ Scribed by Peter Schuster
- Publisher
- John Wiley and Sons
- Year
- 1969
- Tongue
- English
- Weight
- 733 KB
- Volume
- 3
- Category
- Article
- ISSN
- 0020-7608
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📜 SIMILAR VOLUMES
ultra-violet absorption epectra of many nitro paraffin derivatives containing hydroxyl and or amino groups, do not show a maximum (260-270 rnr) typical of the nitro group. This is attributed to the formation of six-membered chelate rings by internal hydrogen bonds between the nitro and hydroxyl or a
## Abstract The hydrogen‐bonded complex between nitric acid and ammonia molecules has been studied by the __ab initio__ molecular orbital method using the 4‐31G basis set. The calculated interaction energy for the complex (Δ__E__ = −91.4 kJ mole^−1^) indicates that one is dealing with the strongest