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C~28~H~20~Br~2~Fe~4~In~2~O~8~

Sample Originator: Simon Aldridgea.

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

Structure Determination: Simon J. Colesb.

University of Oxforda
University of Southamptonb

C28H20Br2Fe4In2O8

InChI=1/C5H6.C5H5.4CH3O.BrH.2Fe.In.2H/c2*1-2-4-5-3-1;4*1-2;;;;;;/h1-4H,5H2;1-5H;4*2H,1H2;1H;;;;;/q;;;;;;;;;+1;;/p-1

Controlled Keywords:metal carbenes
Date Created:05 September 2005
Deposited On:17 Feb 2010 13:48
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaC28 H20 Br2 Fe4 In2 O8
Crystal morphologyPlate
Crystal systemTriclinic
Space group symbolP-1
Cell length a6.71040(10)
Cell length b9.9705(3)
Cell length c12.0246(4)
Cell angle alpha106.0930(10)
Cell angle beta90.916(2)
Cell angle gamma90.823(2)
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0230
R Factor (All)0.0261
Weighted R Factor (Obs)0.0499
Weighted R Factor (All)0.0513

Citation: Aldridge, Simon and Coles, Simon J. and Hursthouse, Michael B. (2005) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1178/)
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