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A Density Functional Study on the Coordination of Aldehydes to N -Sulfonyl 1,3,2-Oxazaborolidin-5-one

✍ Scribed by Salvatella, Luis; Ruiz-López, Manuel F.


Book ID
127010215
Publisher
American Chemical Society
Year
1999
Tongue
English
Weight
284 KB
Volume
121
Category
Article
ISSN
0002-7863

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📜 SIMILAR VOLUMES


Quantum chemical modeling of chiral cata
✍ Vesa Nevalainen 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 502 KB

Properties of Lewis acidic oxazaborolidines 1 were investigated by means of ab initio MO methods (RHF, Ksulfonylated 1,3,2-oxazaborolidine 1' as a model). Energies of the coordination of aldehydes to 1 were estimated by using formaldehyde and acrolein adducts of 1' as models. Energies (MP2/6-31G//6-