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 |
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| container_issue | Pt 11 |
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| container_title | Acta Crystallographica E, Structure Reports Online |
| container_volume | 73 |
| creator | Ngoc, Linh Nguyen Quoc, Trung Vu Quoc, Hoan Duong Quoc, Manh Vu Minh, Luong Truong Pham, Chien Thang Van Meervelt, Luc |
| description | 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. |
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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. 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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.</abstract><cop>CHESTER</cop><pub>International Union of Crystallography</pub><oa>free_for_read</oa></addata></record> |
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| title | Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene |
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