Author:
Becker Lisanne,Altenburger Kai,Spannenberg Anke,Arndt Perdita,Rosenthal Uwe
Abstract
The title compound, C12H6Br2N4S, a second polymorph in the triclinic space groupP-1, is presented. As in the earlier reported monoclinic polymorph in the space groupC2/c[Beckeret al.(2016).Chem. Eur. J.In the press], the thiadiazole ring is planar with an r.m.s. deviation of 0.004 Å. The five-membered ring is tilted with respect to the two pyridyl substituents by 23.16 (7) and 49.47 (9)°. In the crystal, molecules are linked by a weak non-bonding Br...N interaction [3.056 (3) Å]. Furthermore, a column of molecules is established along thebaxis by π–π stacking interactions between the pyridine rings [centroid–centroid distances = 3.7014 (16) and 3.5934 (15) Å]. Additionally, a short intermolecular Br...Br contact [3.3791 (6) Å] and Br...π-aryl contacts [3.6815 (11)–3.7659 (12) Å] towards the thiadiazole and pyridine rings are found.
Publisher
International Union of Crystallography (IUCr)
Subject
Rehabilitation,Physical Therapy, Sports Therapy and Rehabilitation,General Medicine
Reference12 articles.
1. Becker, L., Reiss, F., Altenburger, K., Spannenberg, A., Arndt, P., Jiao, H. & Rosenthal, U. (2016). Chem. Eur. J. In the press. doi: 10.1002/chem.201601337.
2. Bruker (2013). SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.
3. Bruker (2014). APEX2 and SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.
4. Mercury: visualization and analysis of crystal structures
5. On the 2,5-diazolic heterocyclic system. I. Crystal and molecular structure of 3,4-diphenyl-1,2,5-selenadiazole and 3,4-diphenyl-1,2,5-thiadiazole
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