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Crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate

In the title compound, C(17)H(17)N O(4)S, the quinoline ring system is nearly planar, with a maximum deviation of 0.0496 (16) Å. A weak intra­molecular C—H⋯O inter­action is observed. In the crystal, C—H⋯O, S—H⋯N and π–π stacking inter­actions between the fused benzene ring of quinoline and the pyri...

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Autores principales: Rihanabanu, Anitha, B. R., Meenakshi, T. G., Kumar, K. Mahesh, Devarajegowda, H. C.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571415/
https://www.ncbi.nlm.nih.gov/pubmed/26396815
http://dx.doi.org/10.1107/S2056989015013596
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author Rihanabanu,
Anitha, B. R.
Meenakshi, T. G.
Kumar, K. Mahesh
Devarajegowda, H. C.
author_facet Rihanabanu,
Anitha, B. R.
Meenakshi, T. G.
Kumar, K. Mahesh
Devarajegowda, H. C.
author_sort Rihanabanu,
collection PubMed
description In the title compound, C(17)H(17)N O(4)S, the quinoline ring system is nearly planar, with a maximum deviation of 0.0496 (16) Å. A weak intra­molecular C—H⋯O inter­action is observed. In the crystal, C—H⋯O, S—H⋯N and π–π stacking inter­actions between the fused benzene ring of quinoline and the pyridine moieties [shortest centroid–centroid distance = 3.6754 (11) Å] are observed. Inversion-related weak C—H⋯O inter­molecular inter­actions diagonally along [010], with R (2) (2)(10) ring motifs, and S—H⋯N inter­molecular inter­actions diagonally along [100], with R (2) (2)(8) ring motifs, are present, forming a three-dimensional network structure. No classical hydrogen bonds are observed.
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spelling pubmed-45714152015-09-22 Crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate Rihanabanu, Anitha, B. R. Meenakshi, T. G. Kumar, K. Mahesh Devarajegowda, H. C. Acta Crystallogr E Crystallogr Commun Data Reports In the title compound, C(17)H(17)N O(4)S, the quinoline ring system is nearly planar, with a maximum deviation of 0.0496 (16) Å. A weak intra­molecular C—H⋯O inter­action is observed. In the crystal, C—H⋯O, S—H⋯N and π–π stacking inter­actions between the fused benzene ring of quinoline and the pyridine moieties [shortest centroid–centroid distance = 3.6754 (11) Å] are observed. Inversion-related weak C—H⋯O inter­molecular inter­actions diagonally along [010], with R (2) (2)(10) ring motifs, and S—H⋯N inter­molecular inter­actions diagonally along [100], with R (2) (2)(8) ring motifs, are present, forming a three-dimensional network structure. No classical hydrogen bonds are observed. International Union of Crystallography 2015-07-22 /pmc/articles/PMC4571415/ /pubmed/26396815 http://dx.doi.org/10.1107/S2056989015013596 Text en © Rihanabanu 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
Rihanabanu,
Anitha, B. R.
Meenakshi, T. G.
Kumar, K. Mahesh
Devarajegowda, H. C.
Crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate
title Crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate
title_full Crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate
title_fullStr Crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate
title_full_unstemmed Crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate
title_short Crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate
title_sort crystal structure of diethyl 2-[(2-sulfan­yl­quinolin-3-yl)methyl­idene]malonate
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571415/
https://www.ncbi.nlm.nih.gov/pubmed/26396815
http://dx.doi.org/10.1107/S2056989015013596
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