Sample Originator: Craig Buttsa.
Data Collection: Simon J. Colesb and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb.
University of Exetera
University of Southamptonb
C25H43BF4N2
InChI=1/C25H43N2.BF3.FH/c1-3-5-7-9-11-13-17-21-26-23-27(25-20-16-15-19-24(25)26)22-18-14-12-10-8-6-4-2;2-1(3)4;/h15-16,19-20,23H,3-14,17-18,21-22H2,1-2H3;;1H
| Identification Number: | 10.5258/ecrystals/955 |
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| Controlled Keywords: | structures of ionic liquids |
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| Date Created: | 02 October 2003 |
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| Deposited On: | 08 Nov 2013 16:34 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C25 H43 B F4 N2 |
| Crystal morphology | |
| Crystal system | Triclinic |
| Space group symbol | P-1 |
| Cell length a | 9.4091(4) |
| Cell length b | 9.8882(4) |
| Cell length c | 17.1789(9) |
| Cell angle alpha | 74.183(2) |
| Cell angle beta | 89.432(2) |
| Cell angle gamma | 63.982(3) |
| Data collection temperature | 293(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0853 |
| R Factor (All) | 0.2223 |
| Weighted R Factor (Obs) | 0.1932 |
| Weighted R Factor (All) | 0.2471 |
Citation: Butts, Craig and Coles, Simon J. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/955)
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