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Crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate

In the title solvate, C(15)H(15)N(3)O(2)S·CH(3)OH, the thio­semicarbazone mol­ecule is approximately planar; the maximum deviation from the mean plane is 0.4659 (14) Å and the dihedral angle between the aromatic rings is 9.83 (8)°. This conformation is supported by an intra­molecular N—H⋯N hydrogen...

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Autores principales: de Oliveira, Adriano Bof, Beck, Johannes, Landvogt, Christian, Feitosa, Bárbara Regina Santos
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4420048/
https://www.ncbi.nlm.nih.gov/pubmed/25995922
http://dx.doi.org/10.1107/S2056989015007227
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author de Oliveira, Adriano Bof
Beck, Johannes
Landvogt, Christian
Feitosa, Bárbara Regina Santos
author_facet de Oliveira, Adriano Bof
Beck, Johannes
Landvogt, Christian
Feitosa, Bárbara Regina Santos
author_sort de Oliveira, Adriano Bof
collection PubMed
description In the title solvate, C(15)H(15)N(3)O(2)S·CH(3)OH, the thio­semicarbazone mol­ecule is approximately planar; the maximum deviation from the mean plane is 0.4659 (14) Å and the dihedral angle between the aromatic rings is 9.83 (8)°. This conformation is supported by an intra­molecular N—H⋯N hydrogen bond. In the crystal, the thio­semicarbazone mol­ecules are linked into dimers by pairs of N—H⋯S hydrogen bonds, thereby generating R (2) (2)(8) loops. The methanol solvent mol­ecule bonds to the thio­semicarbazone mol­ecule through a bifurcated O—H⋯(O,O) hydrogen bond and also accepts an O—H⋯O link from the thio­semicarbazone mol­ecule. Together, these links generate a three-dimensional network.
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spelling pubmed-44200482015-05-20 Crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate de Oliveira, Adriano Bof Beck, Johannes Landvogt, Christian Feitosa, Bárbara Regina Santos Acta Crystallogr E Crystallogr Commun Data Reports In the title solvate, C(15)H(15)N(3)O(2)S·CH(3)OH, the thio­semicarbazone mol­ecule is approximately planar; the maximum deviation from the mean plane is 0.4659 (14) Å and the dihedral angle between the aromatic rings is 9.83 (8)°. This conformation is supported by an intra­molecular N—H⋯N hydrogen bond. In the crystal, the thio­semicarbazone mol­ecules are linked into dimers by pairs of N—H⋯S hydrogen bonds, thereby generating R (2) (2)(8) loops. The methanol solvent mol­ecule bonds to the thio­semicarbazone mol­ecule through a bifurcated O—H⋯(O,O) hydrogen bond and also accepts an O—H⋯O link from the thio­semicarbazone mol­ecule. Together, these links generate a three-dimensional network. International Union of Crystallography 2015-04-18 /pmc/articles/PMC4420048/ /pubmed/25995922 http://dx.doi.org/10.1107/S2056989015007227 Text en © Oliveira et al. 2015 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 Data Reports
de Oliveira, Adriano Bof
Beck, Johannes
Landvogt, Christian
Feitosa, Bárbara Regina Santos
Crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate
title Crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate
title_full Crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate
title_fullStr Crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate
title_full_unstemmed Crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate
title_short Crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate
title_sort crystal structure of 4-hy­droxy-3-meth­oxy­benzaldehyde 4-methyl­thio­semi­carbazone methanol monosolvate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4420048/
https://www.ncbi.nlm.nih.gov/pubmed/25995922
http://dx.doi.org/10.1107/S2056989015007227
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