Sample Originator: Ian. R. Butlera.
Data Collection: Peter N. Hortonb and Michael B. Hursthouseb
Structure Determination: Peter N. Hortonb.
University of Wales, Bangora
University of Southamptonb
C38H76Cl2FeO6P2Pd
InChI=1/C23H39P.C15H27P.2ClH.Fe.6H2O.Pd/c1-16(2)24(17(3)4,22-14-12-10-9-11-13-15-22)23-20(7)18(5)19(6)21(23)8;1-9(2)16(10(3)4)15-13(7)11(5)12(6)14(15)8;;;;;;;;;;/h9-10,15-17,22,24H,11-14H2,1-8H3;9-10,16H,1-8H3;2*1H;;6*1H2;/q;+1;;;;;;;;;;/p-1/t22-;;;;;;;;;;;/m0.........../s1
| Identification Number: | 10.5258/ecrystals/657 |
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| Controlled Keywords: | palladium compounds, ferrocene compounds |
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| Date Created: | 04 June 2004 |
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| Deposited On: | 09 Mar 2009 14:05 |
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| Deposited By: | Dr Peter N Horton |
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Data collection parameters
| Chemical formula | C38 H76 Cl2 Fe O6 P2 Pd |
| Crystal morphology | Sheet |
| Crystal system | monoclinic |
| Space group symbol | P2(1)/c |
| Cell length a | 23.024(2) |
| Cell length b | 12.4019(6) |
| Cell length c | 15.5740(10) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 109.102(7) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0477 |
| R Factor (Obs) | 0.0320 |
| R Factor (All) | 0.0389 |
| Weighted R Factor (Obs) | 0.0765 |
| Weighted R Factor (All) | 0.0799 |
Citation: Butler, Ian. R. and Horton, Peter N. and Hursthouse, Michael B. (2004) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/657)
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