Electronic and conformational effects on .pi.-facial stereoselectivity in nucleophilic additions to carbonyl compounds
β Scribed by Wu, Yun Dong; Houk, K. N.
- Book ID
- 120460615
- Publisher
- American Chemical Society
- Year
- 1987
- Tongue
- English
- Weight
- 389 KB
- Volume
- 109
- Category
- Article
- ISSN
- 0002-7863
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π SIMILAR VOLUMES
Summarv : The transition state structures for addition of LiH to 1, 2, and 3 are computed and analyzed at MP2/6-3lG(d)//HF/6\_3lG(d). Three factors are found to be important for the relative energies of the transition state structures: (i) the conformational energy of the aldehyde; (ii) the interac
## SummarV : The conformational profiles for rotation around the C-C(=O) bond a and the energy minimum conformations are calculated for propionaldehyde 1, chloroacetaldehyde 2, MP2/6-3lG(d)//HF/6\_3lG(d). and 2-chloropropionaldehyde 3 at a function of a for 1, 2, The energy level of the LUMO is ca