Cargando…

2-[(Diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate

The title compound, C(11)H(20)N(2)PS(+)·BF(4) (−), is a salt of 2-(diisopropyl­thio­phospho­ryl­amino)­pyridine, a chelating bidentate ligand that furnishes an S atom as a soft donor and a pyridine N atom as a hard atom for transition-metal complexation. The title salt crystallizes with two formula...

Descripción completa

Detalles Bibliográficos
Autores principales: Holzhacker, Christian, Kirchner, Karl, Mereiter, Kurt
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379407/
https://www.ncbi.nlm.nih.gov/pubmed/22719605
http://dx.doi.org/10.1107/S1600536812022295
_version_ 1782236192932102144
author Holzhacker, Christian
Kirchner, Karl
Mereiter, Kurt
author_facet Holzhacker, Christian
Kirchner, Karl
Mereiter, Kurt
author_sort Holzhacker, Christian
collection PubMed
description The title compound, C(11)H(20)N(2)PS(+)·BF(4) (−), is a salt of 2-(diisopropyl­thio­phospho­ryl­amino)­pyridine, a chelating bidentate ligand that furnishes an S atom as a soft donor and a pyridine N atom as a hard atom for transition-metal complexation. The title salt crystallizes with two formula units in the asymmetric unit. The two independent cations are protonated at the pyridine N atoms and have the S atoms syn-oriented to them so as to form bent intra­molecular N—H⋯S hydrogen bonds, one of which one is bifurcated by involving also an N—H⋯F inter­action. The phospho­ryl­amino NH groups form near linear hydrogen bonds to proximal tetra­fluoro­borate anions. Five weak C—H⋯F and three weak C—H⋯S inter­actions link the constituents into a three-dimensional framework. As a result of the crystal packing, the two cations differ notably in conformation, as can be seen from the S—P—N—C torsion angles of −18.7 (1)° in the first and −35.1 (1)° in the second cation.
format Online
Article
Text
id pubmed-3379407
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-33794072012-06-20 2-[(Diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate Holzhacker, Christian Kirchner, Karl Mereiter, Kurt Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(11)H(20)N(2)PS(+)·BF(4) (−), is a salt of 2-(diisopropyl­thio­phospho­ryl­amino)­pyridine, a chelating bidentate ligand that furnishes an S atom as a soft donor and a pyridine N atom as a hard atom for transition-metal complexation. The title salt crystallizes with two formula units in the asymmetric unit. The two independent cations are protonated at the pyridine N atoms and have the S atoms syn-oriented to them so as to form bent intra­molecular N—H⋯S hydrogen bonds, one of which one is bifurcated by involving also an N—H⋯F inter­action. The phospho­ryl­amino NH groups form near linear hydrogen bonds to proximal tetra­fluoro­borate anions. Five weak C—H⋯F and three weak C—H⋯S inter­actions link the constituents into a three-dimensional framework. As a result of the crystal packing, the two cations differ notably in conformation, as can be seen from the S—P—N—C torsion angles of −18.7 (1)° in the first and −35.1 (1)° in the second cation. International Union of Crystallography 2012-05-23 /pmc/articles/PMC3379407/ /pubmed/22719605 http://dx.doi.org/10.1107/S1600536812022295 Text en © Holzhacker et al. 2012 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
Holzhacker, Christian
Kirchner, Karl
Mereiter, Kurt
2-[(Diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate
title 2-[(Diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate
title_full 2-[(Diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate
title_fullStr 2-[(Diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate
title_full_unstemmed 2-[(Diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate
title_short 2-[(Diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate
title_sort 2-[(diisopropyl­thio­phosphor­yl)amino]­pyridinium tetra­fluoro­borate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379407/
https://www.ncbi.nlm.nih.gov/pubmed/22719605
http://dx.doi.org/10.1107/S1600536812022295
work_keys_str_mv AT holzhackerchristian 2diisopropylthiophosphorylaminopyridiniumtetrafluoroborate
AT kirchnerkarl 2diisopropylthiophosphorylaminopyridiniumtetrafluoroborate
AT mereiterkurt 2diisopropylthiophosphorylaminopyridiniumtetrafluoroborate