Sample Originator: John Spencerb.
Data Collection: Graham J. Tizzarda and Michael B. Hursthousea
Structure Determination: Graham J. Tizzarda.
University of Southamptona
University of Greenwichb
C22H18N4O4
InChI=1/C22H18N4O4/c27-20(30-15-16-8-6-7-13-23-16)14-25-18-11-4-5-12-19(18)26(22(29)24-21(25)28)17-9-2-1-3-10-17/h1-13H,14-15H2,(H,24,28,29)
| Identification Number: | 10.5258/ecrystals/1227 |
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| Controlled Keywords: | Oxindole |
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| Date Created: | 16 December 2009 |
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| Deposited On: | 16 Feb 2010 11:14 |
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| Deposited By: | Dr G J Tizzard |
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Data collection parameters
| Chemical formula | C22 H18 N4 O4 |
| Crystal morphology | Plate |
| Crystal system | triclinic |
| Space group symbol | P -1 |
| Cell length a | 8.3907(5) |
| Cell length b | 8.7207(4) |
| Cell length c | 15.3024(9) |
| Cell angle alpha | 87.410(4) |
| Cell angle beta | 75.837(3) |
| Cell angle gamma | 62.831(3) |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.1043 |
| R Factor (All) | 0.1629 |
| Weighted R Factor (Obs) | 0.1950 |
| Weighted R Factor (All) | 0.2259 |
Citation: Tizzard, Graham J. and Hursthouse, Michael B. and Spencer, John (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1227)
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