Acta Crystallographica Section E

Volume 67, Part 7 (July 2011)

organic compounds

rz2604 scheme

Acta Cryst. (2011). E67, o1600 [ doi:10.1107/S1600536811020666 ]

4-(Morpholin-4-yl)-3-(trifluoromethyl)benzonitrile

H.-K. Fun, S. I. J. Asik, R. Kumar, A. M. Isloor and K. N. Shivananda

Abstract: In the title benzonitrile compound, C₁₂H₁₁F₃N₂O, an intramolecular C-HF hydrogen bond generates an S(7) ring motif. The trifluoromethyl group is disordered over two orientations with a refined occupancy ratio of 0.549 (16):0.451 (16). The morpholine ring adopts a chair conformation. The benzene ring and mean plane of the morpholine ring make a dihedral angle of 58.04 (10)° with each other. In the crystal, molecules are connected by intermolecular C-HF and C-HO interactions to form R²₂(8) ring motifs. These interactions also link the molecules into chains parallel to the [10 $\overline{1}$ ] direction.


	Hyper-Text Markup Language (HTML) file (67.0 kbytes) [ doi:10.1107/S1600536811020666/rz2604sup0.html ] Supplementary materials

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