Sample Originator: Abdurrahaman Sengulb.

Data Collection: Simon J. Colesa

Structure Determination: Simon J. Colesa and Michael B. Hursthousea.

University of Southamptona
Karaelmas Universityb



Identification Number:10.5258/ecrystals/624
Date Created:12 January 2009
Deposited On:12 Jan 2009 18:14
Deposited By:Dr Simon J Coles

Depositor Comments

Low temperature collection of KOBSID

Data collection parameters

Chemical formulaC12 H6 N4
Crystal morphologyBlade
Crystal systemMonoclinic
Space group symbolP2(1)/c
Cell length a3.74770(10)
Cell length b10.0209(3)
Cell length c12.8933(3)
Cell angle alpha90.00
Cell angle beta91.718(2)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0268
R Factor (Obs)0.0583
R Factor (All)0.0612
Weighted R Factor (Obs)0.1326
Weighted R Factor (All)0.1361

Citation: Coles, Simon J. and Hursthouse, Michael B. and Sengul, Abdurrahaman (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/624)
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