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
C42H41Cl4Cu4N11O24
InChI=1/2C18H15N4O2.2C2H6N.C2H3N.4ClHO.4Cu.16H2O/c2*23-17-10-2-1-6-13(17)12-20-22-18(24)16-9-5-8-15(21-16)14-7-3-4-11-19-14;3*1-2-3;4*1-2;;;;;;;;;;;;;;;;;;;;/h2*1-11,18,23H,12H2;2*3H,2H2,1H3;1H3;4*2H;;;;;16*1H2/q2*-3;2*-1;;;;;;+2;+3;2*+4;;;;;;;;;;;;;;;;/p-5
| Identification Number: | 10.5258/ecrystals/979 |
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| Controlled Keywords: | copper compounds, supramolecular assemblies |
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| Date Created: | 26 August 2003 |
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| Deposited On: | 08 Nov 2013 15:18 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C42 H41 Cl4 Cu4 N11 O24 |
| Crystal morphology | |
| Crystal system | Triclinic |
| Space group symbol | P-1 |
| Cell length a | 7.94040(10) |
| Cell length b | 19.2434(2) |
| Cell length c | 19.4392(2) |
| Cell angle alpha | 111.1960(10) |
| Cell angle beta | 101.5680(10) |
| Cell angle gamma | 92.2640(10) |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.1172 |
| R Factor (Obs) | 0.0529 |
| R Factor (All) | 0.0707 |
| Weighted R Factor (Obs) | 0.1223 |
| Weighted R Factor (All) | 0.1322 |
Citation: Matthews, Craig J. and Horton, Peter N. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/979)
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