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
C30.5H53Cl3FeP2Pd
InChI=1/2C15H29P.2ClH.Fe.Pd/c2*1-9(2)16(10(3)4)15-13(7)11(5)12(6)14(15)8;;;;/h2*9-10,13-14,16H,1-8H3;2*1H;;/q2*+1;;;;/p-2
| Identification Number: | 10.5258/ecrystals/656 |
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| Controlled Keywords: | palladium compounds, ferrocene compounds |
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| Date Created: | 07 June 2004 |
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| Deposited On: | 09 Mar 2009 10:34 |
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| Deposited By: | Dr Peter N Horton |
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Depositor Comments
6-163
Data collection parameters
| Chemical formula | C30.50 H53 Cl3 Fe P2 Pd |
| Crystal morphology | Slab |
| Crystal system | monoclinic |
| Space group symbol | P2(1)/c |
| Cell length a | 19.4376(15) |
| Cell length b | 11.1178(11) |
| Cell length c | 30.276(3) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 91.579(8) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0545 |
| R Factor (Obs) | 0.0293 |
| R Factor (All) | 0.0401 |
| Weighted R Factor (Obs) | 0.0650 |
| Weighted R Factor (All) | 0.0689 |
Citation: Butler, Ian. R. and Horton, Peter N. and Hursthouse, Michael B. (2004) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/656)
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