Ethyl 3-methyl-1-oxo-4H-1,4-benzothiazine-2-carboxylate
✍ Scribed by Akkurt, Mehmet ;Türktekin, Sevim ;Baryala, Yamna ;Zerzouf, Abdelfettah ;Salem, Moussa ;Essassi, El-Mokhtar ;Büyükgüngör, Orhan
- Publisher
- International Union of Crystallography
- Year
- 2005
- Tongue
- English
- Weight
- 160 KB
- Volume
- 61
- Category
- Article
- ISSN
- 1600-5368
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✦ Synopsis
The crystal structure of the title compound, C 12 H 13 NO 3 S, is stabilized by intermolecular N-HÁ Á ÁO hydrogen bonds, which are formed between the NH groups and the sulfoxide O atoms.
📜 SIMILAR VOLUMES
In the essentially planar molecule of the title compound, C 9 H 8 N 2 O 2 S, the dihedral angle between the benzene and thiadiaole rings is 0.44 (7) . In the crystal structure, molecules are stabilized byinteractions and van der Waals forces.
The title compound, C 15 H 17 N 3 O 3 S, a potent new plant elicitor, was synthesized by reaction between 1,2,3-benzothiadiazole-7carbonyl chloride and ethyl piperidine-4-carboxylate. The piperidine ring adopts a chair conformation. Weak intermolecular C-HÁ Á ÁO hydrogen bonds stabilize the crystal
Single-crystal X-ray study T = 293 K Mean '(C±C) = 0.002 A Ê R factor = 0.043 wR factor = 0.128 Data-to-parameter ratio = 12.5 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.