Acta Crystallographica Section E

Structure Reports Online

Volume 68, Part 11 (November 2012)

organic compounds

hg5260 scheme

Acta Cryst. (2012). E68, o3156-o3157    [ doi:10.1107/S1600536812042614 ]

1-[5-Acetyl-2,6-dimethyl-4-(5-phenyl-1H-pyrazol-3-yl)-1,4-dihydropyridin-3-yl]ethanone monohydrate

A. M. Islor, S. Malladi, S. Sundershan, T. Gerber, E. Hosten and R. Betz

Abstract: In the title compound, C20H21N3O2·H2O, the aza-substitued six-membered ring adopts a L4B conformation. In the crystal, classical N-H...O, N-H...N and O-H...O hydrogen bonds connect the entities into a three-dimensional network. Intramolecular C-H...O contacts are also observed.

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[ doi:10.1107/S1600536812042614/hg5260Isup2.cdx ]
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[ doi:10.1107/S1600536812042614/hg5260Isup4.cml ]
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