Sample Originator: B. J. Coea.
Data Collection: Mark E. Lightb and Michael B. Hursthouseb
Structure Determination: Mark E. Lightb.
University of Manchestera
University of Southamptonb
C60H50P4Ru
InChI=1/C26H24P2.C4H.Ru/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-4-2;/h1-20H,21-22H2;1H;/q;;-2/p+2
| Controlled Keywords: | molecular electronics, ruthenium compounds |
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| Date Created: | 12 March 2002 |
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| Deposited On: | 08 Nov 2013 16:14 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C60 H50 P4 Ru |
| Crystal morphology | |
| Crystal system | triclinic |
| Space group symbol | P-1 |
| Cell length a | 9.2135(2) |
| Cell length b | 11.5649(3) |
| Cell length c | 13.2669(4) |
| Cell angle alpha | 110.990(1) |
| Cell angle beta | 96.126(1) |
| Cell angle gamma | 111.168(1) |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0407 |
| R Factor (All) | 0.0537 |
| Weighted R Factor (Obs) | 0.0852 |
| Weighted R Factor (All) | 0.0927 |
Citation: Coe, B. J. and Light, Mark E. and Hursthouse, Michael B. (2002) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1083/)
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