Synthesis and crystal structure of 3-phenyl-1,4,2-di-thia-zole-5-thione.
Acta Crystallogr E Crystallogr Commun
; 78(Pt 10): 1006-1009, 2022 Oct 01.
Article
en En
| MEDLINE
| ID: mdl-36250115
ABSTRACT
In the title compound, C8H5NS3, the dihedral angle between the heterocyclic ring and the phenyl ring is 2.62â
(5)°. In the extended structure, aromatic π-π stacking between the 1,4,2-di-thia-zole-5-thione moiety and the phenyl ring is observed [centroid-centroid distances = 3.717â
(6) and 3.712â
(6)â
Å]. The almost planar mol-ecules arrange themselves in parallel chains of head-to-tail mol-ecules oriented by a network of weak C-Hâ¯S contacts close to the sum of their van der Waals radii within the chains. All the hydrogen atoms participate in hydrogen-bonding inter-actions with the sulfur and nitro-gen atoms of adjacent mol-ecules. C=Sâ¯S contacts between the chains that are significantly shorter than the sum of their van der Waals radii also impact the overall packing.
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1
Colección:
01-internacional
Base de datos:
MEDLINE
Idioma:
En
Revista:
Acta Crystallogr E Crystallogr Commun
Año:
2022
Tipo del documento:
Article
País de afiliación:
Canadá