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2008src0880 (A2) - C48H28Au2Cl4F6OP2

Sample Originator: Stuart L. Jamesa and M. Cristina Lagunasa.

Data Collection: Peter N. Hortonb

Structure Determination: Peter N. Hortonb and Michael B. Hursthouseb.

Queen's University, Belfasta
University of Southamptonb

C48H28Au2Cl4F6OP2

InChI=1/C36H28OP2.2C6Cl2F3.2Au/c1-5-17-29(18-6-1)38(30-19-7-2-8-20-30)35-27-15-13-25-33(35)37-34-26-14-16-28-36(34)39(31-21-9-3-10-22-31)32-23-11-4-12-24-32;2*7-4-2(9)1-3(10)5(8)6(4)11;;/h1-28H;;;;/q;;;2*-1/p+2

Identification Number:10.5258/ecrystals/598
Controlled Keywords:gold complexes, phosphine
Date Created:19 September 2008
Deposited On:19 Sep 2008 10:15
Deposited By:Dr Peter N Horton

Data collection parameters

Chemical formulaC48 H28 Au2 Cl4 F6 O P2
Crystal morphologyBlock
Crystal systemmonoclinic
Space group symbolP2(1)/c
Cell length a12.7644(2)
Cell length b11.9584(2)
Cell length c29.2566(5)
Cell angle alpha90.00
Cell angle beta98.8010(10)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0343
R Factor (All)0.0462
Weighted R Factor (Obs)0.0854
Weighted R Factor (All)0.0968

Citation: James, Stuart L. and Lagunas, M. Cristina and Horton, Peter N. and Hursthouse, Michael B. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/598)
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