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Molecular modelling, NOED and spin—lattice relaxation study of the stereochemistry of some terpenoids

✍ Scribed by Ning Qing; Lawrence D. Colebrook; Fernando Commodari

Publisher
John Wiley and Sons
Year
1991
Tongue
English
Weight
539 KB
Volume
29
Category
Article
ISSN
0749-1581

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✦ Synopsis

Abstract

NOED, COSY and HETCOR experiments in conjunction with molecular mechanics calculations, were used to assign the ^1^H and ^13^C NMR spectra of the terpenoids α‐ionone and methyl O‐methylpodocarpate and to investigate their stereochemistry. These compounds were used as models to investigate the ability of molecular mechanics and associated calculations to predict ^1^H spin—lattice relaxation rates in molecules of this type.

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