Sample Originator: Duncan W. Brucea.
Data Collection: Peter N. Hortonb and Michael B. Hursthouseb
Structure Determination: Peter N. Hortonb.
University of Exetera
University of Southamptonb
C22H20F5NO4Pt
InChI=1/2C15H14NO2.2C7H8F5O2.2Pt/c2*1-17-14-7-3-12(4-8-14)11-16-13-5-9-15(18-2)10-6-13;2*1-2-4(13)3-5(14)6(8,9)7(10,11)12;;/h2*3,5-11H,1-2H3;3,5,13H,2H2,1H3;3-4,14H,2H2,1H3;;/q4*-1;2*+3/p-2/b2*12-11-;4-3-;5-3-;;
| Controlled Keywords: | dendrimers, liquid crystals |
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| Date Created: | 24 November 2003 |
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| Deposited On: | 16 Feb 2010 15:28 |
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| Deposited By: | Mr Steve Lamond |
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Depositor Comments
All hydrogen atoms were fixed.
Data collection parameters
| Chemical formula | C22 H20 F5 N O4 Pt |
| Crystal morphology | |
| Crystal system | Monoclinic |
| Space group symbol | P2(1)/n |
| Cell length a | 14.5057(3) |
| Cell length b | 11.5897(3) |
| Cell length c | 26.1769(6) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 102.3040(10) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0383 |
| R Factor (Obs) | 0.0356 |
| R Factor (All) | 0.0504 |
| Weighted R Factor (Obs) | 0.0716 |
| Weighted R Factor (All) | 0.0762 |
Citation: Bruce, Duncan W. and Horton, Peter N. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1099/)
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