γ-Lithio Ethers and Related Compounds
✍ Scribed by Drury Caine
- Publisher
- John Wiley and Sons
- Year
- 2007
- Weight
- 11 KB
- Volume
- 38
- Category
- Article
- ISSN
- 0931-7597
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## Abstract __Ab initio__ calculations [B3LYP/6‐311++G(2d,2p)] have been carried out on 84 conformations of 12 different sugars (hexoses), in both pyranose and furanose forms, with the idea of generating a data base for carbohydrate structural energies that may be used for developing the predictive
## Abstract The anomeric effect has been studied for a variety of compounds using the MM4 force field, and also using MP2/6‐311++G(2d,2p) __ab initio__ calculations and experimental data for reference purposes. Geometries and energies, including conformational, rotational barriers, and heats of for