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(Meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate

In the cation of the title salt, C(4)H(10)NO(+)·C(24)H(20)B(−)·C(2)H(3)N, the C—N bond lengths are 1.2864 (16), 1.4651 (17) and 1.4686 (16) Å, indicating double- and single-bond character, respectively. The C—O bond length of 1.2978 (15) Å shows double-bond character, pointing towards charge delocal...

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Detalles Bibliográficos
Autores principales: Tiritiris, Ioannis, Saur, Stefan, Kantlehner, Willi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998454/
https://www.ncbi.nlm.nih.gov/pubmed/24765028
http://dx.doi.org/10.1107/S1600536814003481
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author Tiritiris, Ioannis
Saur, Stefan
Kantlehner, Willi
author_facet Tiritiris, Ioannis
Saur, Stefan
Kantlehner, Willi
author_sort Tiritiris, Ioannis
collection PubMed
description In the cation of the title salt, C(4)H(10)NO(+)·C(24)H(20)B(−)·C(2)H(3)N, the C—N bond lengths are 1.2864 (16), 1.4651 (17) and 1.4686 (16) Å, indicating double- and single-bond character, respectively. The C—O bond length of 1.2978 (15) Å shows double-bond character, pointing towards charge delocalization within the NCO plane of the iminium ion. C—H⋯π inter­actions are present between the methine H atom and two of the phenyl rings of the tetra­phenyl­borate ion. The latter forms an aromatic pocket in which the cation is embedded. The iminium ion is further connected through a C—H⋯N hydrogen bond to the aceto­nitrile mol­ecule. This leads to the formation of a two-dimensional supramolecular pattern along the bc plane.
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spelling pubmed-39984542014-04-24 (Meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate Tiritiris, Ioannis Saur, Stefan Kantlehner, Willi Acta Crystallogr Sect E Struct Rep Online Organic Papers In the cation of the title salt, C(4)H(10)NO(+)·C(24)H(20)B(−)·C(2)H(3)N, the C—N bond lengths are 1.2864 (16), 1.4651 (17) and 1.4686 (16) Å, indicating double- and single-bond character, respectively. The C—O bond length of 1.2978 (15) Å shows double-bond character, pointing towards charge delocalization within the NCO plane of the iminium ion. C—H⋯π inter­actions are present between the methine H atom and two of the phenyl rings of the tetra­phenyl­borate ion. The latter forms an aromatic pocket in which the cation is embedded. The iminium ion is further connected through a C—H⋯N hydrogen bond to the aceto­nitrile mol­ecule. This leads to the formation of a two-dimensional supramolecular pattern along the bc plane. International Union of Crystallography 2014-02-22 /pmc/articles/PMC3998454/ /pubmed/24765028 http://dx.doi.org/10.1107/S1600536814003481 Text en © Tiritiris 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
Tiritiris, Ioannis
Saur, Stefan
Kantlehner, Willi
(Meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate
title (Meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate
title_full (Meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate
title_fullStr (Meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate
title_full_unstemmed (Meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate
title_short (Meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate
title_sort (meth­oxy­methyl­idene)di­methyl­aza­nium tetra­phenyl­borate aceto­nitrile monosolvate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998454/
https://www.ncbi.nlm.nih.gov/pubmed/24765028
http://dx.doi.org/10.1107/S1600536814003481
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AT saurstefan methoxymethylidenedimethylazaniumtetraphenylborateacetonitrilemonosolvate
AT kantlehnerwilli methoxymethylidenedimethylazaniumtetraphenylborateacetonitrilemonosolvate