2009src0460 - C1-H7N3O

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/710
Date Created:12 May 2009
Deposited On:15 Nov 2009 17:50
Deposited By:Dr Samantha K Callear

Data collection parameters

Chemical formulaC10 H7 N3 O
Crystal morphology
Crystal systemtriclinic
Space group symbolP-1
Cell length a6.1704(4)
Cell length b7.1051(5)
Cell length c10.8713(6)
Cell angle alpha79.486(4)
Cell angle beta76.174(4)
Cell angle gamma67.853(3)
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0463
R Factor (All)0.0619
Weighted R Factor (Obs)0.1123
Weighted R Factor (All)0.1230

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/710)
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