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/373
Date Created:09 July 2007
Deposited On:31 Jan 2008 13:08
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 formulaC10 H9 N O S
Crystal morphologyNeedle
Crystal systemOrthorhombic
Space group symbolPbca
Cell length a14.2845(8)
Cell length b5.4226(2)
Cell length c22.7593(14)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0702
R Factor (Obs)0.1062
R Factor (All)0.2077
Weighted R Factor (Obs)0.1572
Weighted R Factor (All)0.1995

Citation: Sample, Donated and Huth, Susanne L. and Hursthouse, Michael B. (2007) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/373)
Export as: oreChem EndNote BibTeX ASCII Citation

Repository Staff Only: item control page