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9-[3-(Dimethyl-amino)-prop-yl]-2-trifluoro-meth-yl-9H-thioxanthen-9-ol.

ABSTRACT: In the title compound, C(19)H(20)F(3)NOS, the dihedral angle between the mean planes of the two benzene rings attached to the thioxanthene ring is 41.8?(7)°; the latter has a slightly distorted boat conformation. The F atoms are disordered over three sets of sites [occupancy ratio = 0.564?(10):0.287?(10):0.148?(5)] and the methyl groups are disordered over two sets of sites [occupancy ratio = 0.72?(4):0.28?(4)]. The crystal packing is stabilized by O-H?N and C-H?S hydrogen bonds and weak C-H?Cg inter-actions.

SUBMITTER: Jasinski JP

PROVIDER: S-EPMC3212278 | biostudies-literature | 2011 Aug

REPOSITORIES: biostudies-literature

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9-[3-(Dimethyl-amino)-prop-yl]-2-trifluoro-meth-yl-9H-thioxanthen-9-ol.

Jasinski Jerry P JP Golen James A JA Siddegowda M S MS Yathirajan H S HS Swamy M T MT

Acta crystallographica. Section E, Structure reports online 20110702 Pt 8

In the title compound, C(19)H(20)F(3)NOS, the dihedral angle between the mean planes of the two benzene rings attached to the thioxanthene ring is 41.8 (7)°; the latter has a slightly distorted boat conformation. The F atoms are disordered over three sets of sites [occupancy ratio = 0.564 (10):0.287 (10):0.148 (5)] and the methyl groups are disordered over two sets of sites [occupancy ratio = 0.72 (4):0.28 (4)]. The crystal packing is stabilized by O-H⋯N and C-H⋯S hydrogen bonds and weak C-H⋯Cg ...[more]

PMID: 22090935

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