IUCrData (Apr 2016)

(3aR,6R)-3,3,6-Trimethyl-3,3a,4,5,6,7-hexahydro-2H-indazole-2-carbothioamide

  • Abdellah N'Ait Ousidi,
  • My Youssef Ait Itto,
  • Aziz Auhmani,
  • Abdelkhalek Riahi,
  • Sylviane Chevreux,
  • Moha Berraho

DOI
https://doi.org/10.1107/S2414314616005733
Journal volume & issue
Vol. 1, no. 4
p. x160573

Abstract

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The title compound, C11H19N3S, was prepared by the reaction of (R)-pulegone with thiosemicarbazide in acidic medium, using ethanol as solvent. The molecule is built up from fused six and five-membered rings. The six-membered ring adopts a chair conformation, while the five-membered ring displays an envelope conformation with the dimethyl-substituted C atom as the flap. The dihedral angle between the mean planes of the two rings is 20.35 (6)°. In the crystal, molecules are linked by N—H...N and N—H...S hydrogen bonds into chains running parallel to [100].

Keywords