Sample Originator: Craig Buttsa.
Data Collection: Simon J. Colesb and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb.
University of Exetera
University of Southamptonb
C13H19BF4N2
InChI=1/C13H19N2.BF3.FH/c1-11(2)8-9-15-10-14(3)12-6-4-5-7-13(12)15;2-1(3)4;/h4-7,10-11H,8-9H2,1-3H3;;1H
| Identification Number: | 10.5258/ecrystals/966 |
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| Controlled Keywords: | structures of ionic liquids |
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| Date Created: | 02 February 2004 |
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| Deposited On: | 08 Nov 2013 16:36 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C13 H19 B F4 N2 |
| Crystal morphology | |
| Crystal system | Triclinic |
| Space group symbol | P-1 |
| Cell length a | 8.6774(3) |
| Cell length b | 9.0176(3) |
| Cell length c | 10.0740(3) |
| Cell angle alpha | 107.625(2) |
| Cell angle beta | 96.197(2) |
| Cell angle gamma | 102.871(2) |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0517 |
| R Factor (All) | 0.0575 |
| Weighted R Factor (Obs) | 0.1286 |
| Weighted R Factor (All) | 0.1338 |
Citation: Butts, Craig and Coles, Simon J. and Hursthouse, Michael B. (2004) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/966)
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