Crystal structure of (E)-2-[1-(1,3-benzodioxol-5-yl)ethylidene]-N-ethylhydrazine-1-carbothioamide

Oliveira, Adriano Bof de; Farias, Renan Lira de; Näther, Christian; Jess, Inke

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Campo DC	Valor	Idioma
dc.contributor.author	Oliveira, Adriano Bof de	-
dc.contributor.author	Farias, Renan Lira de	-
dc.contributor.author	Näther, Christian	-
dc.contributor.author	Jess, Inke	-
dc.date.accessioned	2026-03-10T19:28:25Z	-
dc.date.available	2026-03-10T19:28:25Z	-
dc.date.issued	2015	-
dc.identifier.citation	OLIVEIRA, A. B. et al. Crystal structure of (E)-2-[1-(1,3-benzodioxol-5-yl)ethylidene]-N-ethylhydrazine-1-carbothioamide. Acta Crystallographica Section E, Chester, v. 71, n. 3, 2015. Disponível em: https://journals.iucr.org/e/issues/2015/03/00/xu5837/index.html. Acesso em: 10 mar. 2026.	pt_BR
dc.identifier.issn	2056-9890	-
dc.identifier.uri	https://ri.ufs.br/jspui/handle/riufs/24732	-
dc.language	eng	pt_BR
dc.publisher	International Union of Crystallography	pt_BR
dc.relation.ispartof	Acta Crystallographica Section E	pt_BR
dc.subject	Crystal structure	eng
dc.subject	Thiosemicarbazone	eng
dc.subject	Benzo[d][1,3]dioxole	eng
dc.subject	N—HS hydrogen bonds	eng
dc.title	Crystal structure of (E)-2-[1-(1,3-benzodioxol-5-yl)ethylidene]-N-ethylhydrazine-1-carbothioamide	pt_BR
dc.type	Artigo	pt_BR
dc.identifier.license	Creative Commons Atribuição 2.0 Reino unido: Inglaterra e País de Gales (CC BY 2.0 UK)	pt_BR
dc.description.resumo	In the title compound, C12H15N3O2S, the 1,3-benzdioxole fragment is nearly planar [the maximum deviation being 0.0515 (14) A˚ ], the N—N—C( S)—N fragment is also nearly planar [the maximum deviation being 0.0480 (10) A˚ ], and the dihedral angle between their mean planes is 23.49 (10). In the crystal, molecules are linked by pairs of N—HS hydrogen bonds, forming inversion dimers. The dimers are stacked along the a axis with neighbouring columns having the same direction; however, the molecules show different orientations leading to a centrosymmetric arrangement. In the crystal, the methylene group of the ethyl substituent and the terminal methyl H atoms are disordered over two sets of sites and were refined using a split model with an occupancy ratio of 0.5:0.5.	pt_BR
dc.description.local	Chester	pt_BR
dc.identifier.doi	https://doi.org/10.1107/S2056989015003837	-
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