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/1374
Date Created:14 July 2008
Deposited On:30 Mar 2011 18:00
Deposited By:Mrs L. Susanne Coles (née) Huth

Data collection parameters

Chemical formulaC11 H13 N O3
Crystal morphologyCut Block
Crystal systemTriclinic
Space group symbolP-1
Cell length a5.7366(2)
Cell length b8.5492(5)
Cell length c10.6373(6)
Cell angle alpha93.974(2)
Cell angle beta99.351(3)
Cell angle gamma95.314(3)
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0410
R Factor (Obs)0.0498
R Factor (All)0.0579
Weighted R Factor (Obs)0.1362
Weighted R Factor (All)0.1442

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/1374)
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