C~57~H~72~ClN~4~O~3~Ru, C~18~BF~16~

Sample Originator: Eric G. Hopea.

Data Collection: Peter N. Hortonb and Michael B. Hursthouseb

Structure Determination: Peter N. Hortonb.

University of Leicestera
University of Southamptonb



Controlled Keywords:ruthenium compounds
Date Created:07 February 2005
Deposited On:17 Feb 2010 16:39
Deposited By:Mr Steve Lamond

Depositor Comments

All hydrogen atoms were fixed. The anion was completely disordered over two main positions. The anions (Cl- and CO-) around the ruthenium were also disordered, with the best (sensible fitting) ratio of 1:3.

Data collection parameters

Chemical formulaC75 H72 B Cl F16 N4 O3 Ru
Crystal morphologyCut Block
Crystal systemmonoclinic
Space group symbolC2/c
Cell length a18.253(3)
Cell length b23.128(7)
Cell length c16.974(5)
Cell angle alpha90.00
Cell angle beta102.535(19)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0663
R Factor (All)0.0953
Weighted R Factor (Obs)0.1484
Weighted R Factor (All)0.1658

Citation: Hope, Eric G. and Horton, Peter N. and Hursthouse, Michael B. (2005) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1070/)
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