2009src0518 - C16H16N6O3

Sample Originator: John Spencera and Hiren Patela.

Data Collection: Samantha K. Callearb and Michael B. Hursthouseb

Structure Determination: Samantha K. Callearb.

University of Greenwicha
University of Southamptonb



Identification Number:10.5258/ecrystals/712
Date Created:12 May 2009
Deposited On:15 Nov 2009 18:31
Deposited By:Dr Samantha K Callear

Depositor Comments

user local code HP177

Data collection parameters

Chemical formulaC16 H16 N6 O3
Crystal morphologyBlock
Crystal systemmonoclinic
Space group symbolP21/n
Cell length a11.5481(4)
Cell length b8.4612(4)
Cell length c16.5109(8)
Cell angle alpha90.00
Cell angle beta98.323(3)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0607
R Factor (All)0.1033
Weighted R Factor (Obs)0.1434
Weighted R Factor (All)0.1698

Citation: Spencer, John and Patel, Hiren and Callear, Samantha K. and Hursthouse, Michael B. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/712)
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