Sample Originator: Donated Samplea.

Data Collection: Susanne L. Huthb and Michael B. Hursthouseb

Structure Determination: Susanne L. Huthb.

Sample kindly provided by Maybridgea
University of Southamptonb



Identification Number:10.5258/ecrystals/374
Date Created:12 July 2007
Deposited On:31 Jan 2008 13:05
Deposited By:Mrs L. Susanne Coles (née) Huth

Depositor Comments

More information about this compound can be found at: http://www.maybridge.com/

Data collection parameters

Chemical formulaC6 H7 N O S
Crystal morphologyPlate
Crystal systemTriclinic
Space group symbolP-1
Cell length a10.0846(3)
Cell length b10.4718(3)
Cell length c10.9149(3)
Cell angle alpha106.7180(10)
Cell angle beta111.473(2)
Cell angle gamma95.603(2)
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0570
R Factor (Obs)0.0699
R Factor (All)0.0943
Weighted R Factor (Obs)0.1732
Weighted R Factor (All)0.1960

Citation: Sample, Donated and Huth, Susanne L. and Hursthouse, Michael B. (2007) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/374)
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