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N-[3-(Dimethylamino)propyl]-N,N′,N′,N′′,N′′-pentamethylguanidinium tetraphenylborate
In the title salt, C(11)H(27)N(4) (+)·C(24)H(20)B(−), the C—N bond lengths in the central CN(3) unit of the guanidinium ion are 1.333 (4), 1.334 (4) and 1.351 (4) Å, indicating partial double-bond character. The C atom of this unit is bonded to the three N atoms in a nearly ideal trigonal-planar geo...
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2013
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3772473/ https://www.ncbi.nlm.nih.gov/pubmed/24046616 http://dx.doi.org/10.1107/S1600536813014906 |
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author | Tiritiris, Ioannis |
author_facet | Tiritiris, Ioannis |
author_sort | Tiritiris, Ioannis |
collection | PubMed |
description | In the title salt, C(11)H(27)N(4) (+)·C(24)H(20)B(−), the C—N bond lengths in the central CN(3) unit of the guanidinium ion are 1.333 (4), 1.334 (4) and 1.351 (4) Å, indicating partial double-bond character. The C atom of this unit is bonded to the three N atoms in a nearly ideal trigonal-planar geometry [N—C—N angles = 118.8 (3), 120.0 (3) and 121.2 (3)°] 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 have values in the range 1.459 (4)–1.478 (4) Å, close to a typical single bond. In the crystal, there are C—H⋯π interactions between the guanidinium H atoms and the phenyl rings of the tetraphenylborate ion. These interactions combine to form a ladder of linked chains of ions which runs parallel to the c axis. |
format | Online Article Text |
id | pubmed-3772473 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-37724732013-09-17 N-[3-(Dimethylamino)propyl]-N,N′,N′,N′′,N′′-pentamethylguanidinium tetraphenylborate Tiritiris, Ioannis Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title salt, C(11)H(27)N(4) (+)·C(24)H(20)B(−), the C—N bond lengths in the central CN(3) unit of the guanidinium ion are 1.333 (4), 1.334 (4) and 1.351 (4) Å, indicating partial double-bond character. The C atom of this unit is bonded to the three N atoms in a nearly ideal trigonal-planar geometry [N—C—N angles = 118.8 (3), 120.0 (3) and 121.2 (3)°] 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 have values in the range 1.459 (4)–1.478 (4) Å, close to a typical single bond. In the crystal, there are C—H⋯π interactions between the guanidinium H atoms and the phenyl rings of the tetraphenylborate ion. These interactions combine to form a ladder of linked chains of ions which runs parallel to the c axis. International Union of Crystallography 2013-06-08 /pmc/articles/PMC3772473/ /pubmed/24046616 http://dx.doi.org/10.1107/S1600536813014906 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-[3-(Dimethylamino)propyl]-N,N′,N′,N′′,N′′-pentamethylguanidinium tetraphenylborate |
title |
N-[3-(Dimethylamino)propyl]-N,N′,N′,N′′,N′′-pentamethylguanidinium tetraphenylborate |
title_full |
N-[3-(Dimethylamino)propyl]-N,N′,N′,N′′,N′′-pentamethylguanidinium tetraphenylborate |
title_fullStr |
N-[3-(Dimethylamino)propyl]-N,N′,N′,N′′,N′′-pentamethylguanidinium tetraphenylborate |
title_full_unstemmed |
N-[3-(Dimethylamino)propyl]-N,N′,N′,N′′,N′′-pentamethylguanidinium tetraphenylborate |
title_short |
N-[3-(Dimethylamino)propyl]-N,N′,N′,N′′,N′′-pentamethylguanidinium tetraphenylborate |
title_sort | n-[3-(dimethylamino)propyl]-n,n′,n′,n′′,n′′-pentamethylguanidinium tetraphenylborate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3772473/ https://www.ncbi.nlm.nih.gov/pubmed/24046616 http://dx.doi.org/10.1107/S1600536813014906 |
work_keys_str_mv | AT tiritirisioannis n3dimethylaminopropylnnnnnpentamethylguanidiniumtetraphenylborate |