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1-Benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate
In the title salt, C(23)H(23)N(2)O(+)·PF(6) (−), the PF(6) (−) anion is highly disordered (occupancy ratios of 0.35:0.35:0.3, 0.7:0.15:0.15, 0.7:0.3 and 0.35:0.35:0.15:0.15) with the four F atoms in the equatorial plane rotating about the axial F—P—F bond. The mean plane of the imidazole ring makes...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2011
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3213508/ https://www.ncbi.nlm.nih.gov/pubmed/22091087 http://dx.doi.org/10.1107/S1600536811026663 |
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author | Huang, Kun Du, Bin-Xin Liu, Chang-Lu |
author_facet | Huang, Kun Du, Bin-Xin Liu, Chang-Lu |
author_sort | Huang, Kun |
collection | PubMed |
description | In the title salt, C(23)H(23)N(2)O(+)·PF(6) (−), the PF(6) (−) anion is highly disordered (occupancy ratios of 0.35:0.35:0.3, 0.7:0.15:0.15, 0.7:0.3 and 0.35:0.35:0.15:0.15) with the four F atoms in the equatorial plane rotating about the axial F—P—F bond. The mean plane of the imidazole ring makes dihedral angles of 82.44 (17) and 14.39 (16)°, respectively, with the mean planes of the benzene ring and the naphthalene ring system. The crystal structure is stabilized by C—H⋯F hydrogen bonds. In addition, π–π [centroid–centroid distances = 3.7271 (19)–3.8895 (17) Å] and C—H⋯π interactions are observed. |
format | Online Article Text |
id | pubmed-3213508 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32135082011-11-16 1-Benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate Huang, Kun Du, Bin-Xin Liu, Chang-Lu Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title salt, C(23)H(23)N(2)O(+)·PF(6) (−), the PF(6) (−) anion is highly disordered (occupancy ratios of 0.35:0.35:0.3, 0.7:0.15:0.15, 0.7:0.3 and 0.35:0.35:0.15:0.15) with the four F atoms in the equatorial plane rotating about the axial F—P—F bond. The mean plane of the imidazole ring makes dihedral angles of 82.44 (17) and 14.39 (16)°, respectively, with the mean planes of the benzene ring and the naphthalene ring system. The crystal structure is stabilized by C—H⋯F hydrogen bonds. In addition, π–π [centroid–centroid distances = 3.7271 (19)–3.8895 (17) Å] and C—H⋯π interactions are observed. International Union of Crystallography 2011-07-16 /pmc/articles/PMC3213508/ /pubmed/22091087 http://dx.doi.org/10.1107/S1600536811026663 Text en © Huang et al. 2011 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 Huang, Kun Du, Bin-Xin Liu, Chang-Lu 1-Benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate |
title | 1-Benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate |
title_full | 1-Benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate |
title_fullStr | 1-Benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate |
title_full_unstemmed | 1-Benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate |
title_short | 1-Benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate |
title_sort | 1-benzyl-3-[3-(naphthalen-2-yloxy)propyl]imidazolium hexafluorophosphate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3213508/ https://www.ncbi.nlm.nih.gov/pubmed/22091087 http://dx.doi.org/10.1107/S1600536811026663 |
work_keys_str_mv | AT huangkun 1benzyl33naphthalen2yloxypropylimidazoliumhexafluorophosphate AT dubinxin 1benzyl33naphthalen2yloxypropylimidazoliumhexafluorophosphate AT liuchanglu 1benzyl33naphthalen2yloxypropylimidazoliumhexafluorophosphate |