Please use this identifier to cite or link to this item:
https://ri.ufs.br/jspui/handle/riufs/26100| Document Type: | Artigo |
| Title: | Crystal structure of N-ethyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylidene) hydrazinecarbothioamide |
| Authors: | Oliveira, Adriano Bof de Beck, Johannes Landvogt, Christian Farias, Renan Lira de Feitoza, Bárbara Regina Santos |
| Issue Date: | 2017 |
| Resumo : | There are two crystallographically independent molecules in the asymmetric unit of the title compound, C13H17N3S, one of them being disordered over the methyl group [site-occupancy ratio = 0.705 (5):0.295 (5)]. The maximum r.m.s. deviations from the mean plane of the non-H atoms for the tetralone fragments amount to 0.4572 (17) and 0.4558 (15) A˚ . The N—N—C—N fragments are not planar and torsion angles are 9.4 (2) and 8.3 (2). In the crystal, the molecules are linked by weak N—H. . .S interactions into chains along [100] with graph-set motif C(4) and connected by weak N—H. . .S and C—H . . .S interactions, forming R2 1 (10) rings. The Hirshfeld surface analysis indicates that the most important contributions for the crystal packing are the H. . .H (64.20%), H S (12.60%) and H . . C (12.00%) interactions. The crystal packing resembles a herringbone arrangement when viewed along [001]. |
| Keywords: | Crystal structure Tetralone thiosemicarbazone derivative Hirshfeld surface calculation |
| ISSN: | 2056-9890 |
| Is part of: | Acta Crystallographica Section E |
| Language: | eng |
| Publisher / Institution : | International Union of Crystallography |
| Citation: | OLIVEIRA, A. B. et al. Crystal structure of N-ethyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylidene) hydrazinecarbothioamide. Acta Crystallographica Section E, Chester, v. 73, n. 2, 2017. Disponível em: https://journals.iucr.org/e/issues/2017/02/00/lh5835/index.html. Acesso em: 14 set. 2026. |
| License: | Creative Commons Atribuição 2.0 Reino unido: Inglaterra e País de Gales (CC BY 2.0 UK) |
| Identifier: | https://doi.org/10.1107/S2056989017001311 |
| URI: | https://ri.ufs.br/jspui/handle/riufs/26100 |
| Appears in Collections: | DQI - Artigos de periódicos |
Files in This Item:
| File | Description | Size | Format | |
|---|---|---|---|---|
| CrystalStructureN-ethyl-2-(1,2,3,4-Tetrahydronaphthalen.pdf | 1,05 MB | Adobe PDF |  View/Open |
Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.