## Abstract The details of two‐dimensional ^13^C^1^H correlated spectra have provided information about the relative signs of __J__(C, F) and __J__(F, H) for several molecules in which C, F and H are mutually coupled. Unlike signs are found for __J__(C, F) and __J__(F, H) when the coupling pathway
Configurational assignment of carbon, silicon and germanium containing propynal oximes by means of 13C1H, 13C13C and 15N1H spin–spin coupling constants
✍ Scribed by Kirill A. Chernyshev; Leonid B. Krivdin; Lyudmila I. Larina; Tatiana V. Konkova; Maria M. Demina; Alevtina S. Medvedeva
- Publisher
- John Wiley and Sons
- Year
- 2007
- Tongue
- English
- Weight
- 277 KB
- Volume
- 45
- Category
- Article
- ISSN
- 0749-1581
- DOI
- 10.1002/mrc.2017
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✦ Synopsis
Abstract
Configurational assignment of five carbon, silicon and germanium containing propynal oximes has been carried out by means of experimental measurements and high‐level ab initio calculations of their ^13^C^1^H, ^13^C^13^C and ^15^N^1^H spin–spin coupling constants. The title compounds were shown to exist in the nonequilibrium mixture of E and Z isomers with the energy difference of less than 0.3 kcal/mol calculated at the MP2/6‐311G** level. Copyright © 2007 John Wiley & Sons, Ltd.
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