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2-(5-Iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate
The molecule of the title compound, C(9)H(7)IN(4)OS, is almost planar (r.m.s. deviation = 0.0373 Å). In the molecule, N—H⋯N and N—H⋯O hydrogen bonds generate, respectively, S(5) and S(6) ring motifs. In the crystal, molecules are linked via N—H⋯O hydrogen bonds, forming chains propagating along [...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4051098/ https://www.ncbi.nlm.nih.gov/pubmed/24940248 http://dx.doi.org/10.1107/S1600536814010782 |
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author | Conceição Duarte de Bittencourt, Viviane Carratu Gervini, Vanessa Rosa de Menezes Vicenti, Juliano Maciel Velasques, Jecika Jussiane Zambiazi, Priscilla |
author_facet | Conceição Duarte de Bittencourt, Viviane Carratu Gervini, Vanessa Rosa de Menezes Vicenti, Juliano Maciel Velasques, Jecika Jussiane Zambiazi, Priscilla |
author_sort | Conceição Duarte de Bittencourt, Viviane |
collection | PubMed |
description | The molecule of the title compound, C(9)H(7)IN(4)OS, is almost planar (r.m.s. deviation = 0.0373 Å). In the molecule, N—H⋯N and N—H⋯O hydrogen bonds generate, respectively, S(5) and S(6) ring motifs. In the crystal, molecules are linked via N—H⋯O hydrogen bonds, forming chains propagating along [010]. These chains are linked via S⋯I contacts [3.4915 (16) Å], forming sheets lying parallel to (100). A region of disordered electron density, probably a disordered tetrahydrofuran solvent molecule, was treated using the SQUEEZE routine in PLATON [Spek (2009). Acta Cryst. D65, 148–155]. The formula mass and unit-cell characteristics were not taken into account during refinement. |
format | Online Article Text |
id | pubmed-4051098 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-40510982014-06-17 2-(5-Iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate Conceição Duarte de Bittencourt, Viviane Carratu Gervini, Vanessa Rosa de Menezes Vicenti, Juliano Maciel Velasques, Jecika Jussiane Zambiazi, Priscilla Acta Crystallogr Sect E Struct Rep Online Organic Papers The molecule of the title compound, C(9)H(7)IN(4)OS, is almost planar (r.m.s. deviation = 0.0373 Å). In the molecule, N—H⋯N and N—H⋯O hydrogen bonds generate, respectively, S(5) and S(6) ring motifs. In the crystal, molecules are linked via N—H⋯O hydrogen bonds, forming chains propagating along [010]. These chains are linked via S⋯I contacts [3.4915 (16) Å], forming sheets lying parallel to (100). A region of disordered electron density, probably a disordered tetrahydrofuran solvent molecule, was treated using the SQUEEZE routine in PLATON [Spek (2009). Acta Cryst. D65, 148–155]. The formula mass and unit-cell characteristics were not taken into account during refinement. International Union of Crystallography 2014-05-17 /pmc/articles/PMC4051098/ /pubmed/24940248 http://dx.doi.org/10.1107/S1600536814010782 Text en © Conceição Duarte de Bittencourt et al. 2014 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Organic Papers Conceição Duarte de Bittencourt, Viviane Carratu Gervini, Vanessa Rosa de Menezes Vicenti, Juliano Maciel Velasques, Jecika Jussiane Zambiazi, Priscilla 2-(5-Iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate |
title | 2-(5-Iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate |
title_full | 2-(5-Iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate |
title_fullStr | 2-(5-Iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate |
title_full_unstemmed | 2-(5-Iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate |
title_short | 2-(5-Iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate |
title_sort | 2-(5-iodo-2-oxoindolin-3-ylidene)hydrazinecarbothioamide including an unknown solvate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4051098/ https://www.ncbi.nlm.nih.gov/pubmed/24940248 http://dx.doi.org/10.1107/S1600536814010782 |
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