Sample Originator: Simon J. Lancastera.
Data Collection: Simon J. Colesb and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb.
University of East Angliaa
University of Southamptonb
C42H43B2F15LiO3P
InChI=1/C18BF15.C12H11P.3C4H10O.BH3.Li.H/c20-4-1(5(21)11(27)16(32)10(4)26)19(2-6(22)12(28)17(33)13(29)7(2)23)3-8(24)14(30)18(34)15(31)9(3)25;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;3*1-3-5-4-2;;;/h;1-10,13H;3*3-4H2,1-2H3;1H3;;
| Controlled Keywords: | metallic polymers, catalysis |
|---|
| Date Created: | 01 February 2005 |
|---|
| Deposited On: | 17 Feb 2010 13:09 |
|---|
| Deposited By: | Mr Steve Lamond |
|---|
Data collection parameters
| Chemical formula | C42 H43 B2 F15 Li O3 P |
| Crystal morphology | Block |
| Crystal system | Triclinic |
| Space group symbol | P-1 |
| Cell length a | 12.9559(9) |
| Cell length b | 13.0944(7) |
| Cell length c | 14.6714(6) |
| Cell angle alpha | 79.742(4) |
| Cell angle beta | 80.895(5) |
| Cell angle gamma | 61.807(4) |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0506 |
| R Factor (Obs) | 0.0381 |
| R Factor (All) | 0.0481 |
| Weighted R Factor (Obs) | 0.0955 |
| Weighted R Factor (All) | 0.1016 |
Citation: Lancaster, Simon J. and Coles, Simon J. and Hursthouse, Michael B. (2005) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1137/)
Export as: oreChem EndNote BibTeX ASCII Citation
