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/1368
Date Created:01 March 2009
Deposited On:30 Mar 2011 17:14
Deposited By:Mrs L. Susanne Coles (née) Huth

Data collection parameters

Chemical formulaC8 H8 Cl N O
Crystal morphologytablet
Crystal systemOrthorhombic
Space group symbolP b c a
Cell length a10.5174(2)
Cell length b9.4252(4)
Cell length c16.2656(6)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0726
R Factor (Obs)0.0389
R Factor (All)0.0490
Weighted R Factor (Obs)0.0920
Weighted R Factor (All)0.0966

Citation: Coles (née Huth), Susanne L. and Threlfall, Terry L. and Hursthouse, Michael B. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1368)
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