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Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene
The title compound, C(11)H(7)NS(2), 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...
| Autores principales: | , , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2017
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5683482/ https://www.ncbi.nlm.nih.gov/pubmed/29152342 http://dx.doi.org/10.1107/S2056989017014530 |
| _version_ | 1783278290007490560 |
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| author | Nguyen Ngoc, Linh Vu Quoc, Trung Duong Quoc, Hoan Vu Quoc, Manh Truong Minh, Luong Thang Pham, Chien Van Meervelt, Luc |
| author_facet | Nguyen Ngoc, Linh Vu Quoc, Trung Duong Quoc, Hoan Vu Quoc, Manh Truong Minh, Luong Thang Pham, Chien Van Meervelt, Luc |
| author_sort | Nguyen Ngoc, Linh |
| collection | PubMed |
| description | The title compound, C(11)H(7)NS(2), 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 π–π stacking between the aromatic rings, together with C—H⋯π, C—H⋯S and C—H⋯N interactions, result in a herringbone motif in the crystal packing. |
| format | Online Article Text |
| id | pubmed-5683482 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2017 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-56834822017-11-17 Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene Nguyen Ngoc, Linh Vu Quoc, Trung Duong Quoc, Hoan Vu Quoc, Manh Truong Minh, Luong Thang Pham, Chien Van Meervelt, Luc Acta Crystallogr E Crystallogr Commun Research Communications The title compound, C(11)H(7)NS(2), 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 π–π stacking between the aromatic rings, together with C—H⋯π, C—H⋯S and C—H⋯N interactions, result in a herringbone motif in the crystal packing. International Union of Crystallography 2017-10-13 /pmc/articles/PMC5683482/ /pubmed/29152342 http://dx.doi.org/10.1107/S2056989017014530 Text en © Nguyen Ngoc et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
| spellingShingle | Research Communications Nguyen Ngoc, Linh Vu Quoc, Trung Duong Quoc, Hoan Vu Quoc, Manh Truong Minh, Luong Thang Pham, Chien Van Meervelt, Luc Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene |
| title | Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene |
| title_full | Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene |
| title_fullStr | Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene |
| title_full_unstemmed | Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene |
| title_short | Green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene |
| title_sort | green synthesis and crystal structure of 3-(benzothiazol-2-yl)thiophene |
| topic | Research Communications |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5683482/ https://www.ncbi.nlm.nih.gov/pubmed/29152342 http://dx.doi.org/10.1107/S2056989017014530 |
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