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Acta Cryst. (2011). E67, o816-o817  [ doi:10.1107/S1600536811007665 ]

2-Chloro-N-{5-[(4R,5R,10S)-dehydroabiet-4-yl]-1,3,4-thiadiazol-2-yl}benzamide

Q. Mo, W. Duan, X. Ma, J. Huang and Z. Ma

Abstract: There are two independent molecules in the asymmetric unit of the title compound, C28H32ClN3OS (systematic name: 2-chloro-N-{5-[(1R,4aS,10aR)-7-isopropyl-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthren-1-yl]-1,3,4-thiadiazol-2-yl}benzamide). In each molecule, the cyclohexyl ring attached to the thiadiazole fragment adopts a classic chair conformation with two of its two methyl groups in the axial positions. In the crystal, pairs of intermolecular N-H...N hydrogen bonds link the molecules into centrosymmetric dimers, which are further linked via C-H...[pi] interactions.

Online 9 March 2011


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