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N-Acetonylsaccharin
In the title compound [systematic name: 2-(2-oxopropyl)-1,2-benzothiazol-3(2H)-one 1,1-dioxide], C(10)H(9)NO(4)S, the benzothiazole unit is essentially planar [maximum deviation = 0.0490 (9) Å for the S atom] and the oxopropyl group is inclined at an angle 75.61 (8)° with respect to its mean pla...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970051/ https://www.ncbi.nlm.nih.gov/pubmed/21577589 http://dx.doi.org/10.1107/S1600536809030773 |
Sumario: | In the title compound [systematic name: 2-(2-oxopropyl)-1,2-benzothiazol-3(2H)-one 1,1-dioxide], C(10)H(9)NO(4)S, the benzothiazole unit is essentially planar [maximum deviation = 0.0490 (9) Å for the S atom] and the oxopropyl group is inclined at an angle 75.61 (8)° with respect to its mean plane. In the crystal, molecules are held together by weak intermolecular C—H⋯O non-classical hydrogen bonds, resulting in centrosymmetric dimeric units, forming 14-membered ring systems which may be described as R (2) (2)(14) ring motifs. Moreover, molecules lying about inversion centers show π–π interactions, with centroid–centroid separations between the benzene rings of 3.676 (2) Å. |
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