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4-Chloro-5-[(5,5-dimethyl-4,5-dihydro-isoxazol-3-yl)sulfonyl-meth-yl]-3-methyl-1-(2,2,2-trifluoro-ethyl)-1H-pyrazole.

ABSTRACT: The mol-ecule of the title compound, C(12)H(15)ClF(3)N(3)O(3)S, is twisted, as indicated by the C-S-C-C torsion angle of 66.00?(18)° for the atoms linking the ring systems. An intra-molecular C-H?F short contact occurs. In the crystal, non-classical C-H?O inter-actions, one of which has a short H?O contact of 2.28?Å, link the mol-ecules.

SUBMITTER: Ma HJ 

PROVIDER: S-EPMC2970275 | biostudies-other | 2009

REPOSITORIES: biostudies-other

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4-Chloro-5-[(5,5-dimethyl-4,5-dihydro-isoxazol-3-yl)sulfonyl-meth-yl]-3-methyl-1-(2,2,2-trifluoro-ethyl)-1H-pyrazole.

Ma Hong-Ju HJ   Zhao Qian-Fei QF   Mei Xiang-Dong XD   Ning Jun J  

Acta crystallographica. Section E, Structure reports online 20090930 Pt 10

The mol-ecule of the title compound, C(12)H(15)ClF(3)N(3)O(3)S, is twisted, as indicated by the C-S-C-C torsion angle of 66.00 (18)° for the atoms linking the ring systems. An intra-molecular C-H⋯F short contact occurs. In the crystal, non-classical C-H⋯O inter-actions, one of which has a short H⋯O contact of 2.28 Å, link the mol-ecules. ...[more]