Sample Originator: Mark E. Wooda.

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

Structure Determination: Simon J. Colesb and Steven J. Lamondb.

University of Exetera
University of Southamptonb



Controlled Keywords:heterocycles, iodine compounds
Date Created:07 March 2002
Deposited On:16 Feb 2010 11:11
Deposited By:Mr Steve Lamond

Depositor Comments

Resolved as original files lost.

Data collection parameters

Chemical formulaC20 H22 I2 N2 O2
Crystal morphology
Crystal systemOrthorhombic
Space group symbolPca2(1)
Cell length a13.4920(5)
Cell length b4.7287(2)
Cell length c31.3743(16)
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)0.0394
R Factor (All)0.0580
Weighted R Factor (Obs)0.0674
Weighted R Factor (All)0.0726

Citation: Wood, Mark E. and Coles, Simon J. and Hursthouse, Michael B. and Lamond, Steven J. (2002) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/999/)
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