C~21~H~20~O~4~S~3~ - C21H20O4S3

Sample Originator: Peter J. Skabaraa.

Data Collection: Peter N. Hortonb and Michael B. Hursthouseb

Structure Determination: Peter N. Hortonb.

University of Strathclydea
University of Southamptonb



Controlled Keywords:organic compounds
Date Created:15 January 2003
Deposited On:16 Feb 2010 14:46
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaC21 H20 O4 S3
Crystal morphology
Crystal systemMonoclinic
Space group symbolP2(1)/c
Cell length a8.5912(2)
Cell length b7.70070(10)
Cell length c30.6182(6)
Cell angle alpha90.00
Cell angle beta91.7610(10)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0692
R Factor (Obs)0.0423
R Factor (All)0.0616
Weighted R Factor (Obs)0.0973
Weighted R Factor (All)0.1070

Citation: Skabara, Peter J. and Horton, Peter N. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1158/)
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