## Abstract The charge separation between the dithiole ring and oxygen in 3‐(1′,2′‐dithiole‐3′‐ylidene)‐6‐methyl‐2,3‐dihydropyran‐2,4‐diones and 3‐(1′,2′‐dithiole‐3′‐ylidene)‐2,3‐dihydrobenzo[__b__] pyran‐2,4‐diones has been determined by ^13^C and ^19^F n.m.r. spectroscopy. By both methods it is f
The structure of α-(1,2-dithiole-3-ylidene) ketones and α-(1,2-dithiole-3-ylidene) aldehydes studied by means of n.m.r. spectroscopy
✍ Scribed by Carl Th. Pedersen; Erik G. Frandsen; Kjeld Schaumburg
- Publisher
- John Wiley and Sons
- Year
- 1977
- Tongue
- English
- Weight
- 615 KB
- Volume
- 9
- Category
- Article
- ISSN
- 0749-1581
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✦ Synopsis
Abstract
1H and ^13^C n.m.r. studies of a series of twelve 1,2‐dithiole‐3‐ylidene ketones and aldehydes have shown that the geometry of the carbon backbone is the same as found in 1,6,6aλ^4^‐trithiapentalenes. No evidence has been found which favours a bicyclic structure for the system. A linear correlation of observed ^13^C chemical shifts with calculated charge densities is found to be valid. The observations are in agreement with a structure which is a hybrid between a true ketonic structure and a true mesoionic structure.
By using the difference in the ^13^C chemical shifts of ortho and meta carbon atoms in substituent phenyl groups it is possible to qualify the degree of coplanarity of the phenyl groups with the backbone of the molecule.
📜 SIMILAR VOLUMES
## Abstract The 1‐NH structure for 3‐azidoindazole has been demonstrated by the observation of ^1^H^1^H and ^13^C^1^H couplings involving the hydrogen atom attached to nitrogen. A comparison between 3‐azidoindazole and indazole shows that both compounds have the same tautomeric structure.