Sample Originator: Terry L. Threlfalla.

Data Collection: Susanne L. Hutha

Structure Determination: Susanne L. Hutha and Michael B. Hursthousea.

University of Southamptona



Identification Number:10.5258/ecrystals/686
Date Created:06 November 2008
Deposited On:03 Apr 2009 11:10
Deposited By:Mrs L. Susanne Coles (née) Huth

Data collection parameters

Chemical formulaC13 H10 F2 N2 O
Crystal morphologyCut Lath
Crystal systemMonoclinic
Space group symbolC2/c
Cell length a20.7183(7)
Cell length b12.6104(5)
Cell length c9.1726(3)
Cell angle alpha90.00
Cell angle beta109.300(2)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0340
R Factor (Obs)0.0595
R Factor (All)0.0835
Weighted R Factor (Obs)0.1137
Weighted R Factor (All)0.1270

Citation: Huth, Susanne L. and Threlfall, Terry L. and Hursthouse, Michael B. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/686)
Export as: oreChem EndNote BibTeX ASCII Citation

Repository Staff Only: item control page