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Acta Cryst. (2005). E61, o3022-o3024  [ doi:10.1107/S1600536805026280 ]

Methyl 4-tert-butoxycarbonyl-N-cyanopiperazine-1-carboximidothioate

B.-J. Lan, P. Guo, Z.-G. Zou and Y.-X. Lu

Abstract: The title compound, C12H20N4O2S, has been synthesized for use as an intermediate for antihypertensive agents, potential antimalarials and molecular rectification materials. The intermolecular S...N non-bonded separation within a column in the crystal structure is 3.308 (2) Å, indicating a strong intermolecular interaction between the cyano groups and the S atoms. Attractive C-H...O hydrogen bonds are responsible for zigzag molecular chains propagating in the a-axis direction; these types of intermolecular interactions combine to form an extended three-dimensional network in the lattice.

Online 20 August 2005


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