Sample Originator: Terry L. Threlfalla.

Data Collection: Susanne L. Coles (née Huth)a

Structure Determination: Susanne L. Coles (née Huth)a and Michael B. Hursthousea.

University of Southamptona



Identification Number:10.5258/ecrystals/1362
Date Created:21 July 2008
Deposited On:30 Mar 2011 17:08
Deposited By:Mrs L. Susanne Coles (née) Huth

Data collection parameters

Chemical formulaC8 H8 F N O
Crystal morphologyCut Block
Crystal systemOrthorhombic
Space group symbolPbca
Cell length a10.5132(4)
Cell length b9.4393(3)
Cell length c15.1635(5)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0698
R Factor (Obs)0.0394
R Factor (All)0.0474
Weighted R Factor (Obs)0.1005
Weighted R Factor (All)0.1056

Citation: Coles (née Huth), Susanne L. and Threlfall, Terry L. and Hursthouse, Michael B. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1362)
Export as: oreChem EndNote BibTeX ASCII Citation

Repository Staff Only: item control page