Sample Originator: Andy Peltera.
Data Collection: Simon J. Colesb and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb.
University College of Swanseaa
University of Southamptonb
C21H25NO2
InChI=1/2C21H25NO2.CH4/c2*1-3-22(4-2)21(24)19-13-15-5-6-16-8-10-18(20(23)14-16)12-11-17(19)9-7-15;/h2*7-10,13-14,23H,3-6,11-12H2,1-2H3;1H4
| Date Created: | 01 February 2001 |
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| Deposited On: | 23 Dec 2014 13:39 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C21 H25 N O2 |
| Crystal morphology | |
| Crystal system | Monoclinic |
| Space group symbol | Cc |
| Cell length a | 7.7318(15) |
| Cell length b | 27.917(6) |
| Cell length c | 16.430(3) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 102.48(3) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 150(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.1084 |
| R Factor (All) | 0.1774 |
| Weighted R Factor (Obs) | 0.2424 |
| Weighted R Factor (All) | 0.2832 |
Citation: Pelter, Andy and Coles, Simon J. and Hursthouse, Michael B. (2001) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/779/)
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