2006src0700 - C3H4BrCl4N4O4P3

Sample Originator: David B. Daviesb, A. Kilicc and A. Usluc.

Data Collection: Simon J. Colesa

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

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



Identification Number:10.5258/ecrystals/487
Date Created:06 July 2008
Deposited On:06 Jul 2008 19:58
Deposited By:Dr Simon J Coles

Data collection parameters

Chemical formulaC3 H4 Br Cl4 N4 O4 P3
Crystal morphologySlab
Crystal systemOrthorhombic
Space group symbolPbca
Cell length a13.0288(4)
Cell length b12.2797(4)
Cell length c18.0331(5)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0472
R Factor (Obs)0.0384
R Factor (All)0.0559
Weighted R Factor (Obs)0.0902
Weighted R Factor (All)0.0981

Citation: Coles, Simon J. and Hursthouse, Michael B. and Davies, David B. and Kilic, A. and Uslu, A. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/487)
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