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N,N,N′,N′,N′′-Penta­methyl-N′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate)

In the crystal structure of the title salt, C(12)H(30)N(4) (2+)·2C(24)H(20)B(−), the C—N bond lengths in the central CN(3) unit of the guanidinium ion are 1.3388 (17), 1.3390 (16) and 1.3540 (17) Å, indicating partial double-bond character in each. The central C atom is bonded to the three N atoms i...

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Autor principal: Tiritiris, Ioannis
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569815/
https://www.ncbi.nlm.nih.gov/pubmed/23424561
http://dx.doi.org/10.1107/S1600536813001992
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author Tiritiris, Ioannis
author_facet Tiritiris, Ioannis
author_sort Tiritiris, Ioannis
collection PubMed
description In the crystal structure of the title salt, C(12)H(30)N(4) (2+)·2C(24)H(20)B(−), the C—N bond lengths in the central CN(3) unit of the guanidinium ion are 1.3388 (17), 1.3390 (16) and 1.3540 (17) Å, indicating partial double-bond character in each. The central C atom is bonded to the three N atoms in a nearly ideal trigonal-planar geometry and the positive charge is delocalized in the CN(3) plane. The bonds between the N atoms and the terminal C-methyl groups of the guanidinium moiety, all have values close to a typical single bond [1.4630 (16)–1.4697 (17) Å]. C—H⋯π inter­actions are present between the guanidinium H atoms and the phenyl C atoms of one tetra­phenyl­borate ion. The phenyl rings form a kind of aromatic pocket, in which the guanidinium ion is embedded.
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spelling pubmed-35698152013-02-19 N,N,N′,N′,N′′-Penta­methyl-N′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate) Tiritiris, Ioannis Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the title salt, C(12)H(30)N(4) (2+)·2C(24)H(20)B(−), the C—N bond lengths in the central CN(3) unit of the guanidinium ion are 1.3388 (17), 1.3390 (16) and 1.3540 (17) Å, indicating partial double-bond character in each. The central C atom is bonded to the three N atoms in a nearly ideal trigonal-planar geometry and the positive charge is delocalized in the CN(3) plane. The bonds between the N atoms and the terminal C-methyl groups of the guanidinium moiety, all have values close to a typical single bond [1.4630 (16)–1.4697 (17) Å]. C—H⋯π inter­actions are present between the guanidinium H atoms and the phenyl C atoms of one tetra­phenyl­borate ion. The phenyl rings form a kind of aromatic pocket, in which the guanidinium ion is embedded. International Union of Crystallography 2013-01-26 /pmc/articles/PMC3569815/ /pubmed/23424561 http://dx.doi.org/10.1107/S1600536813001992 Text en © Ioannis Tiritiris 2013 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
N,N,N′,N′,N′′-Penta­methyl-N′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate)
title N,N,N′,N′,N′′-Penta­methyl-N′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate)
title_full N,N,N′,N′,N′′-Penta­methyl-N′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate)
title_fullStr N,N,N′,N′,N′′-Penta­methyl-N′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate)
title_full_unstemmed N,N,N′,N′,N′′-Penta­methyl-N′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate)
title_short N,N,N′,N′,N′′-Penta­methyl-N′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate)
title_sort n,n,n′,n′,n′′-penta­methyl-n′′-[3-(tri­methyl­aza­nium­yl)prop­yl]guanidinium bis­(tetra­phenyl­borate)
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569815/
https://www.ncbi.nlm.nih.gov/pubmed/23424561
http://dx.doi.org/10.1107/S1600536813001992
work_keys_str_mv AT tiritirisioannis nnnnnpentamethyln3trimethylazaniumylpropylguanidiniumbistetraphenylborate