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/1366
Date Created:15 December 2008
Deposited On:30 Mar 2011 17:12
Deposited By:Mrs L. Susanne Coles (née) Huth

Data collection parameters

Chemical formulaC9 H8 F3 N O
Crystal morphologyCut Lath
Crystal systemMonoclinic
Space group symbolP21/n
Cell length a4.7821(4)
Cell length b13.4170(16)
Cell length c13.9793(15)
Cell angle alpha90.00
Cell angle beta92.527(7)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0290
R Factor (Obs)0.0663
R Factor (All)0.1021
Weighted R Factor (Obs)0.1260
Weighted R Factor (All)0.1394

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/1366)
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