Sample Originator: Patrick J. Murphya.
Data Collection: Simon J. Colesb and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb.
University of North Walesa
University of Southamptonb
C22H26N2O4
InChI=1/C11H15NO2/c1-2-8-12-11(13)14-9-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,12,13)
| Controlled Keywords: | natural products |
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| Date Created: | 18 November 2004 |
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| Deposited On: | 08 Nov 2013 16:08 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C22 H26 N2 O4 |
| Crystal morphology | Plate |
| Crystal system | Monoclinic |
| Space group symbol | C2/c |
| Cell length a | 41.67(2) |
| Cell length b | 4.965(3) |
| Cell length c | 9.731(7) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 101.49(8) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0690 |
| R Factor (Obs) | 0.1155 |
| R Factor (All) | 0.1422 |
| Weighted R Factor (Obs) | 0.2596 |
| Weighted R Factor (All) | 0.2709 |
Citation: Murphy, Patrick J. and Coles, Simon J. and Hursthouse, Michael B. (2004) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1156/)
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