Abstract
In the title compound, C17H12F3NO4S, the heterocyclic thiazine ring adopts a half-chair conformation with the S and the N atoms displaced by −0.608 (3) and 0.105 (3) Å, respectively, from the mean plane formed by the remaining ring atoms. The dihedral angle between the two benzene rings is 36.63 (8)° and the acetic acid group is inclined at right angles [89.78 (8) °] to the mean plane formed by the C atoms of the thiazine ring. The crystal structure features O—H⋯O and C—H⋯O hydrogen bonds.
Highlights
C17H12F3NO4S, the heterocyclic thiazine ring adopts a half-chair conformation with the S
The N atoms displaced by 0.608 (3) and 0.105 (3) Å, respectively, from the mean plane formed by the remaining ring atoms
The dihedral angle between the two benzene rings is 36.63 (8) and the acetic acid group is inclined at right angles
Summary
Refinement a Department of Applied Chemistry, Beijing Institute of Technology, Zhongguancun. South Street, 100081 Beijing, People’s Republic of China, and bDepartment of Chemistry and Environmental Engineering, Anyang Institute of Technology, Henan. H atoms treated by a mixture of independent and constrained refinement max = 0.32 e Å3. R factor = 0.039; wR factor = 0.108; data-to-parameter ratio = 17.4. C17H12F3NO4S, the heterocyclic thiazine ring adopts a half-chair conformation with the S and the N atoms displaced by 0.608 (3) and 0.105 (3) Å, respectively, from the mean plane formed by the remaining ring atoms. The dihedral angle between the two benzene rings is 36.63 (8) and the acetic acid group is inclined at right angles [89.78 (8) ] to the mean plane formed by the C atoms of the thiazine ring.
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More From: Acta crystallographica. Section E, Structure reports online
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