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Journal Article

(E)-5-[(2-Hy­dr­oxy-5-meth­­oxy­benzyl­­idene)amino]-1,3,4-thia­diazole-2(3H)-thione.

MPS-Authors
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Kia,  R.
Research Group of Structural Dynamics of (Bio)Chemical Systems, MPI for Biophysical Chemistry, Max Planck Society;

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2368695.pdf
(Publisher version), 425KB

Supplementary Material (public)

2368695_Suppl_1.cif
(Supplementary material), 17KB

2368695_Suppl_2.hkl
(Supplementary material), 143KB

2368695_Suppl_3.cml
(Supplementary material), 5KB

Citation

Kargar, H., Kia, R., & Tahir, M. N. (2011). (E)-5-[(2-Hy­dr­oxy-5-meth­­oxy­benzyl­­idene)amino]-1,3,4-thia­diazole-2(3H)-thione. Acta Crystallographica Section E, 67(12): o3311. doi:10.1107/S1600536811047362.


Cite as: https://hdl.handle.net/11858/00-001M-0000-002C-1731-0
Abstract
In the title thione–Schiff base compound, C10H9N3O2S2, the dihedral angle between the benzene ring and the five-membered ring is 6.69 (8)°. An intra­molecular O—H⋯N hydrogen bond forms an S22(6) ring. In the crystal, inversion dimers linked by pairs of N—H⋯S inter­actions occur, generating R22(8) ring motifs. The crystal structure features a S⋯S contact [3.3776 (7) Å], which is significantly shorter than the sum of the van der Waals radii (3.7 Å). The crystal structure also features C—H⋯O and π–π inter­actions [centroid–centroid distances = 3.4636 (9)–3.808 (1) Å].