Sample Originator: Nick Greevesa.
Data Collection: Peter N. Hortonb and Michael B. Hursthouseb
Structure Determination: Peter N. Hortonb.
Liverpool Universitya
University of Southamptonb
C24H32O
InChI=1/2C24H32O/c2*1-7-21(16(2)3)22(15-23(25)20-11-9-8-10-12-20)24-18(5)13-17(4)14-19(24)6/h2*7-14,16,21-23,25H,1,15H2,2-6H3/t2*21-,22+,23+/m10/s1
| Controlled Keywords: | stereochemistry, conformational change |
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| Date Created: | 01 December 2005 |
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| Deposited On: | 17 Feb 2010 14:00 |
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| Deposited By: | Mr Steve Lamond |
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Depositor Comments
Chirality: C1=R, C9=R, C25=R, C33=R.
Data collection parameters
| Chemical formula | C24 H32 O |
| Crystal morphology | Block |
| Crystal system | Monoclinic |
| Space group symbol | P2(1)/c |
| Cell length a | 11.5027(3) |
| Cell length b | 13.7029(2) |
| Cell length c | 27.1787(7) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 101.0000(10) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0453 |
| R Factor (Obs) | 0.0515 |
| R Factor (All) | 0.1035 |
| Weighted R Factor (Obs) | 0.1109 |
| Weighted R Factor (All) | 0.1335 |
Citation: Greeves, Nick and Horton, Peter N. and Hursthouse, Michael B. (2005) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1124/)
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