Sample Originator: Angelo Amorosoa.
Data Collection: Thomas Gelbrichb and Michael B. Hursthouseb
Structure Determination: Thomas Gelbrichb.
Cardiff Universitya
University of Southamptonb
C~28~H~26~Cl~2~Cu~N~4~O~10~
InChI=1/C28H26N4O2.2ClHO.Cu.6H2O/c1-2-14-29-24(11-1)21-32(17-19-33-25-12-3-7-22-9-5-15-30-27(22)25)18-20-34-26-13-4-8-23-10-6-16-31-28(23)26;2*1-2;;;;;;;/h1-16H,17-21H2;2*2H;;6*1H2
| Date Created: | 19 April 2001 |
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| Deposited On: | 23 Dec 2014 12:57 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C28 H26 Cl2 Cu N4 O10 |
| Crystal morphology | |
| Crystal system | Monoclinic |
| Space group symbol | P2(1)/c |
| Cell length a | 11.0240(6) |
| Cell length b | 12.5301(8) |
| Cell length c | 21.1630(14) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 96.560(2) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 150(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0626 |
| R Factor (All) | 0.0978 |
| Weighted R Factor (Obs) | 0.1207 |
| Weighted R Factor (All) | 0.1285 |
Citation: Amoroso, Angelo and Gelbrich, Thomas and Hursthouse, Michael B. (2001) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/832/)
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