2-Trifluoromethyl-1H-benzimidazol-3-ium nitrate
Ihe title salt, C8H6F3N2 +·NO3 −, the F atoms of the triflouromethyl group are disordered over two sets of sites in a 0.58 (2):0.42 (2) ratio. In the crystal, N—H⋯O hydrogen bonds link the cations and anions into chains running parallel to the b axis. There is π–π stacking between symmetry-related b...
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| Format: | Online |
| Language: | English |
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International Union of Crystallography
2012
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| Online Access: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3343977/ |
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pubmed-3343977 |
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pubmed-33439772012-05-15 2-Trifluoromethyl-1H-benzimidazol-3-ium nitrate Liu, Ming-Liang Organic Papers Ihe title salt, C8H6F3N2 +·NO3 −, the F atoms of the triflouromethyl group are disordered over two sets of sites in a 0.58 (2):0.42 (2) ratio. In the crystal, N—H⋯O hydrogen bonds link the cations and anions into chains running parallel to the b axis. There is π–π stacking between symmetry-related benzene rings with a centroid-centroid distance of 3.949 (3) Å. The crystal studied was a non-merohedral twin, with a 19% minor component. International Union of Crystallography 2012-03-10 /pmc/articles/PMC3343977/ /pubmed/22589886 http://dx.doi.org/10.1107/S1600536812009415 Text en © Ming-Liang Liu 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. |
| repository_type |
Open Access Journal |
| institution_category |
Foreign Institution |
| institution |
US National Center for Biotechnology Information |
| building |
NCBI PubMed |
| collection |
Online Access |
| language |
English |
| format |
Online |
| author |
Liu, Ming-Liang |
| spellingShingle |
Liu, Ming-Liang 2-Trifluoromethyl-1H-benzimidazol-3-ium nitrate |
| author_facet |
Liu, Ming-Liang |
| author_sort |
Liu, Ming-Liang |
| title |
2-Trifluoromethyl-1H-benzimidazol-3-ium nitrate |
| title_short |
2-Trifluoromethyl-1H-benzimidazol-3-ium nitrate |
| title_full |
2-Trifluoromethyl-1H-benzimidazol-3-ium nitrate |
| title_fullStr |
2-Trifluoromethyl-1H-benzimidazol-3-ium nitrate |
| title_full_unstemmed |
2-Trifluoromethyl-1H-benzimidazol-3-ium nitrate |
| title_sort |
2-trifluoromethyl-1h-benzimidazol-3-ium nitrate |
| description |
Ihe title salt, C8H6F3N2
+·NO3
−, the F atoms of the triflouromethyl group are disordered over two sets of sites in a 0.58 (2):0.42 (2) ratio. In the crystal, N—H⋯O hydrogen bonds link the cations and anions into chains running parallel to the b axis. There is π–π stacking between symmetry-related benzene rings with a centroid-centroid distance of 3.949 (3) Å. The crystal studied was a non-merohedral twin, with a 19% minor component. |
| publisher |
International Union of Crystallography |
| publishDate |
2012 |
| url |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3343977/ |
| _version_ |
1611527108428824576 |