01SRC108 (922) - C15H17NO4
Sample Originator: Jenny A. Littlechilda. Data Collection: Simon J. Colesb and Michael B. Hursthouseb Structure Determination: Simon J. Colesb. University of Exetera
University of Southamptonb
C15H17NO4 InChI=1/C15H17NO4/c1-19-14(17)12-7-11-8-13(15(18)20-11)16(12)9-10-5-3-2-4-6-10/h2-6,11-13H,7-9H2,1H3/t11-,12-,13+/m1/s1 | Date Created: | 07 February 2001 |
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| Deposited On: | 23 Dec 2014 13:27 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters| Chemical formula | C15 H17 N O4 | | Crystal morphology | | | Crystal system | Monoclinic | | Space group symbol | P2(1) | | Cell length a | 7.6905(15) | | Cell length b | 9.930(2) | | Cell length c | 9.0526(18) | | Cell angle alpha | 90.00 | | Cell angle beta | 97.07(3) | | Cell angle gamma | 90.00 | | Data collection temperature | 150(2) |
Refinement results| Solution figure of merit | | | R Factor (Obs) | 0.0626 | | R Factor (All) | 0.0779 | | Weighted R Factor (Obs) | 0.1451 | | Weighted R Factor (All) | 0.1562 |
Citation: Littlechild, Jenny A. and Coles, Simon J. and Hursthouse, Michael B. (2001) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/780/)
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