Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene

The title compound, C11H7NS2, was prepared in high yield (87%) using a solvent-free microwave-assisted synthesis. The structure shows whole-molecule disorder with occupancies for two orientations (A and B) of 0.4884 (10) and 0.5116 (10), respectively. The thiophene and benzothiazole rings are almost...

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Veröffentlicht in:Acta Crystallographica E, Structure Reports Online Structure Reports Online, 2017, Vol.73 (Pt 11), p.1647
Hauptverfasser: Ngoc, Linh Nguyen, Quoc, Trung Vu, Quoc, Hoan Duong, Quoc, Manh Vu, Minh, Luong Truong, Pham, Chien Thang, Van Meervelt, Luc
Format: Artikel
Sprache:eng
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Zusammenfassung:The title compound, C11H7NS2, was prepared in high yield (87%) using a solvent-free microwave-assisted synthesis. The structure shows whole-molecule disorder with occupancies for two orientations (A and B) of 0.4884 (10) and 0.5116 (10), respectively. The thiophene and benzothiazole rings are almost planar and make dihedral angles of 10.02 (18) and 12.54 (19) for orientations A and B, respectively. Slipped - stacking between the aromatic rings, together with C-H , C-H S and C-H N interactions, result in a herringbone motif in the crystal packing.
ISSN:2056-9890
2056-9890