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Calculations of lanthanide-induced shifts from molecular structure. II

✍ Scribed by Cramer, Roger E.; Dubois, Ronald.; Furuike, Charles K.

Book ID
126797441
Publisher
American Chemical Society
Year
1975
Tongue
English
Weight
457 KB
Volume
14
Category
Article
ISSN
0020-1669

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Molecular conformations of dibucaine in
Molecular conformations of dibucaine in solution as determined by NMR lanthanideβ€”induced shifts and conformational energy calculations
✍ Mufeed Basti; Laurine A. LaPlanche; Garret Vanderkooi πŸ“‚ Article πŸ“… 1987 πŸ› John Wiley and Sons 🌐 English βš– 688 KB

Proton lanthanide-induced shifts (LIS) were measured for Yb(fod),-dibucaine complexes in CDCl, solution. The data were used in conjunction with empirical energy calculations to determine the preferred conformations of dibucaine. The energy calculations and the LIS analysis were in agreement in showi