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Acta Cryst. (2006). E62, o1252-o1253  [ doi:10.1107/S1600536806007240 ]

5-Methyl-1,2,4-triazolo[1,5-a]pyrimidine-6-carbonitrile

J. Lokaj, V. Kettmann, S. Katuscák, P. Cernuchová, V. Milata and F. Gregán

Abstract: The title compound, C7H5N5, was designed and synthesized as a potential antitumour agent. The molecules are located on crystallographic mirror planes. The electron-accepting 6-cyano group has no effect on the [pi]-electron cloud of the heterocyclic system. The molecular packing is governed by C-H...N intermolecular hydrogen bonds, which link the molecules into chains running along the c axis.

Online 8 March 2006


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