The barrier to inversion in NF$ has been studied using ab initio molecular-orbital theory including geometry optimization at the correlation energy level. The barrier is predicted to be 12.6 kcal mol-'. Comparison is made to previous theoretical and experimental results.
โฆ LIBER โฆ
Theoretical Studies of the Inversion Barrier in Corannulenes
โ Scribed by Disch, Raymond L.; Schulman, Jerome M.
- Book ID
- 126788007
- Publisher
- American Chemical Society
- Year
- 1994
- Tongue
- English
- Weight
- 418 KB
- Volume
- 116
- Category
- Article
- ISSN
- 0002-7863
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