2-(Mesitylmethylsulfanyl)pyridine N-oxide monohydrate

In the title compound, C(15)H(17)NOS·H(2)O, the benzene and pyridine rings form a dihedral angle of 71.18 (2)°. The intra­molecular S⋯O distance [2.737 (3) Å] is shorter than expected and, in terms of hybridization principles, the N—C—S angle [114.1 (2)°] is smaller than expected. The crystal struct...

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Autores principales: Ravindran Durai Nayagam, B., Jebas, Samuel Robinson, Johnson Jeyakumar, H., Schollmeyer, Dieter
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959397/
https://www.ncbi.nlm.nih.gov/pubmed/21201156
http://dx.doi.org/10.1107/S1600536808029255
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author Ravindran Durai Nayagam, B.
Jebas, Samuel Robinson
Johnson Jeyakumar, H.
Schollmeyer, Dieter
author_facet Ravindran Durai Nayagam, B.
Jebas, Samuel Robinson
Johnson Jeyakumar, H.
Schollmeyer, Dieter
author_sort Ravindran Durai Nayagam, B.
collection PubMed
description In the title compound, C(15)H(17)NOS·H(2)O, the benzene and pyridine rings form a dihedral angle of 71.18 (2)°. The intra­molecular S⋯O distance [2.737 (3) Å] is shorter than expected and, in terms of hybridization principles, the N—C—S angle [114.1 (2)°] is smaller than expected. The crystal structure is stabilized by inter­molecular O—H⋯O and weak C—H⋯O hydrogen bonds. In addition, weak π–π stacking inter­actions with a centroid–centroid distance of 3.778 (3) Å are also observed.
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spelling pubmed-29593972010-12-30 2-(Mesitylmethylsulfanyl)pyridine N-oxide monohydrate Ravindran Durai Nayagam, B. Jebas, Samuel Robinson Johnson Jeyakumar, H. Schollmeyer, Dieter Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(15)H(17)NOS·H(2)O, the benzene and pyridine rings form a dihedral angle of 71.18 (2)°. The intra­molecular S⋯O distance [2.737 (3) Å] is shorter than expected and, in terms of hybridization principles, the N—C—S angle [114.1 (2)°] is smaller than expected. The crystal structure is stabilized by inter­molecular O—H⋯O and weak C—H⋯O hydrogen bonds. In addition, weak π–π stacking inter­actions with a centroid–centroid distance of 3.778 (3) Å are also observed. International Union of Crystallography 2008-09-17 /pmc/articles/PMC2959397/ /pubmed/21201156 http://dx.doi.org/10.1107/S1600536808029255 Text en © Ravindran Durai Nayagam et al. 2008 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
Ravindran Durai Nayagam, B.
Jebas, Samuel Robinson
Johnson Jeyakumar, H.
Schollmeyer, Dieter
2-(Mesitylmethylsulfanyl)pyridine N-oxide monohydrate
title 2-(Mesitylmethylsulfanyl)pyridine N-oxide monohydrate
title_full 2-(Mesitylmethylsulfanyl)pyridine N-oxide monohydrate
title_fullStr 2-(Mesitylmethylsulfanyl)pyridine N-oxide monohydrate
title_full_unstemmed 2-(Mesitylmethylsulfanyl)pyridine N-oxide monohydrate
title_short 2-(Mesitylmethylsulfanyl)pyridine N-oxide monohydrate
title_sort 2-(mesitylmethylsulfanyl)pyridine n-oxide monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959397/
https://www.ncbi.nlm.nih.gov/pubmed/21201156
http://dx.doi.org/10.1107/S1600536808029255
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