2008src0009 - C5H13Cl3N5OP3

Sample Originator: David B. Daviesb and Adem Kilicc.

Data Collection: Simon J. Colesa

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

University of Southamptona
Birkbeck College, University of Londonb
Gebze Institute of Technologyc



Identification Number:10.5258/ecrystals/414
Date Created:09 May 2008
Deposited On:09 May 2008 00:39
Deposited By:Dr Simon J Coles

Data collection parameters

Chemical formulaC5 H13 Cl3 N5 O P3
Crystal morphologyBlock
Crystal systemMonoclinic
Space group symbolP2(1)n
Cell length a18.3051(5)
Cell length b8.13900(10)
Cell length c39.2691(9)
Cell angle alpha90.00
Cell angle beta101.6620(10)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0537
R Factor (Obs)0.0542
R Factor (All)0.1003
Weighted R Factor (Obs)0.1145
Weighted R Factor (All)0.1337

Citation: Hursthouse, Michael B. and Coles, Simon J. and Davies, David B. and Kilic, Adem (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/414)
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