Sample Originator: Craig J. Matthewsa.
Data Collection: Peter N. Hortonb and Michael B. Hursthouseb
Structure Determination: Peter N. Hortonb.
Nottingham Trent Universitya
University of Southamptonb
C24H18F18N10O22Pb4S6
InChI=1/C9H12N5O.2CHF3O3S.CH3F.CH5O5S2.2F2.FH.H2O2.H2O.2Pb.2H/c1-11-6-8(10)13-14-9(15)7-4-2-3-5-12-7;2*2-1(3,4)8(5,6)7;1-2;1-8(4,5)7(3)6-2;2*1-2;;1-2;;;;;/h2-5,9,14H,1,6,10H2;2*(H,5,6,7);1H3;2-3H,1H3;;;1H;1-2H;1H2;;;;/q-2;;;;;;;;;;+1;+2;;/p-1
| Identification Number: | 10.5258/ecrystals/981 |
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| Controlled Keywords: | lead compounds, supramolecular assemblies |
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| Date Created: | 23 July 2003 |
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| Deposited On: | 08 Nov 2013 15:16 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C24 H18 F18 N10 O22 Pb4 S6 |
| Crystal morphology | |
| Crystal system | Triclinic |
| Space group symbol | P-1 |
| Cell length a | 10.8538(5) |
| Cell length b | 11.3876(7) |
| Cell length c | 12.5537(8) |
| Cell angle alpha | 115.212(2) |
| Cell angle beta | 112.293(3) |
| Cell angle gamma | 94.433(3) |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0289 |
| R Factor (Obs) | 0.0536 |
| R Factor (All) | 0.0864 |
| Weighted R Factor (Obs) | 0.1301 |
| Weighted R Factor (All) | 0.1430 |
Citation: Matthews, Craig J. and Horton, Peter N. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/981)
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