Sample Originator: Peter J. Skabarab and Irina Afoninab.

Data Collection: Simon J. Colesa

Structure Determination: Simon J. Colesa and Michael B. Hursthousea.

University of Southamptona
University of Strathclydeb



Identification Number:10.5258/ecrystals/604
Date Created:26 September 2008
Deposited On:26 Sep 2008 15:24
Deposited By:Dr Simon J Coles

Data collection parameters

Chemical formulaC18 H12 S
Crystal morphologyPlate
Crystal system?
Space group symbol?
Cell length a8.3358(6)
Cell length b26.3096(17)
Cell length c5.6923(3)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0465
R Factor (Obs)0.0629
R Factor (All)0.0780
Weighted R Factor (Obs)0.1449
Weighted R Factor (All)0.1586

Citation: Coles, Simon J. and Hursthouse, Michael B. and Skabara, Peter J. and Afonina, Irina and Kanibolotsky, Alexander (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/604)
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