Sample Originator: Peter J. Hollimana.
Data Collection: Graham J. Tizzardb and Michael B. Hursthouseb
Structure Determination: Steven J. Lamondb.
University of Wales, Bangora
University of Southamptonb
C11H11Br2N
InChI=1/C11H11Br2N/c1-6-11(2,3)8-4-7(12)5-9(13)10(8)14-6/h4-5H,1-3H3
| Identification Number: | 10.5258/ecrystals/1229 |
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| Controlled Keywords: | solar cell fabrication, functional dyes and polymers |
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| Date Created: | 17 December 2009 |
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| Deposited On: | 16 Feb 2010 10:19 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C11 H11 Br2 N |
| Crystal morphology | Block |
| Crystal system | monoclinic |
| Space group symbol | P2(1)/c |
| Cell length a | 12.0452(3) |
| Cell length b | 11.8133(3) |
| Cell length c | 8.0824(2) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 96.646(2) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0417 |
| R Factor (All) | 0.0479 |
| Weighted R Factor (Obs) | 0.1160 |
| Weighted R Factor (All) | 0.1180 |
Citation: Holliman, Peter J. and Tizzard, Graham J. and Hursthouse, Michael B. and Lamond, Steven J. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1229)
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