C~20~H~16~Cl~2~NO~2~, Cl

Sample Originator: Ian Cunnighama.

Data Collection: Simon J. Colesb and Michael B. Hursthouseb

Structure Determination: Simon J. Colesb.

University of Surreya
University of Southamptonb



Controlled Keywords:metabolism, molecular mimicry, metalloporphyrins
Date Created:26 May 2005
Deposited On:17 Feb 2010 16:16
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaC20 H16 Cl3 N O2
Crystal morphologyShard
Crystal systemOrthorhombic
Space group symbolPna2(1)
Cell length a11.681(19)
Cell length b19.120(15)
Cell length c8.296(13)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0540
R Factor (All)0.0865
Weighted R Factor (Obs)0.1000
Weighted R Factor (All)0.1105

Citation: Cunnigham, Ian and Coles, Simon J. and Hursthouse, Michael B. (2005) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1072/)
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