Amide-rotational barriers obtained with a total line shape analysis of a series of parasubstituted N,N-dimethylbenzamides and -cinnamamides are correlated with the result of an H.M.O. ## (a ~~1 . 4 ) calculation. There is no difference in the activation parameters at a concentration of 0.25 M and
Spectroscopic studies on N,N-dimethylamides—III Amide-rotational barriers of N,N-dimethylbenzamides and -cinnamamides. A comparison of the NMR intensity ratio- and iterative total line shape method
✍ Scribed by K. Spaargaren; P. K. Korver; P. J. Der Van Haak; Th. J. de Boer
- Publisher
- John Wiley and Sons
- Year
- 1971
- Tongue
- English
- Weight
- 456 KB
- Volume
- 3
- Category
- Article
- ISSN
- 0749-1581
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✦ Synopsis
Amide-rotational barriers of a series of para-substituted N,N-dimethylbenzarnides and -cinnamamides have been obtained by both the intensity ratio method, according to Rogers and Woodbrey,* and an iterative total line shape analysis.
From a comparison of the results, it is concluded that a discussion of rotational barriers obtained with the intensity ratio method should preferably be based on AGSc values, which are nearly equal for both methods, rather than on AG: a t other temperatures. * Part 11, ref. 1 . I Part of the thesis of K. Spaargaren, Amsterdam 1970.
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hide-rotational barriers in some 2-substituted N,N-dimethylcyclopropanecarboxamides in CDCl, as a solvent (0.25 M) were obtained with an iterative total line shape analysis. ## N,N-dimethylcyclopropanecarboxamide shows a barrier AGZ,., = 16.72 i 0.01 kcal/mole. Para-nitro substitution in (trans)-