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/681
Date Created:14 July 2008
Deposited On:03 Apr 2009 10:33
Deposited By:Mrs L. Susanne Coles (née) Huth

Data collection parameters

Chemical formulaC13 H12 N2 O
Crystal morphologyCut Needle
Crystal systemOrthorhombic
Space group symbolP n a 21
Cell length a9.0662(3)
Cell length b10.3420(4)
Cell length c11.7380(4)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0480
R Factor (Obs)0.0500
R Factor (All)0.0691
Weighted R Factor (Obs)0.0976
Weighted R Factor (All)0.1075

Citation: Huth, Susanne L. and Threlfall, Terry L. and Hursthouse, Michael B. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/681)
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