Sample Originator: Donated Samplea.

Data Collection: Susanne L. Huthb and Michael B. Hursthouseb

Structure Determination: Susanne L. Huthb.

Sample kindly provided by Maybridgea
University of Southamptonb



Identification Number:10.5258/ecrystals/375
Date Created:30 September 2007
Deposited On:31 Jan 2008 13:06
Deposited By:Mrs L. Susanne Coles (née) Huth

Depositor Comments

More information about this compound can be found at: http://www.maybridge.com/

Data collection parameters

Chemical formulaC9 H10 O3
Crystal morphologyCut Shard
Crystal systemOrthorhombic
Space group symbolPna2(1)
Cell length a7.8484(6)
Cell length b8.3983(7)
Cell length c24.1255(18)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0630
R Factor (Obs)0.0938
R Factor (All)0.1106
Weighted R Factor (Obs)0.2549
Weighted R Factor (All)0.2736

Citation: Sample, Donated and Huth, Susanne L. and Hursthouse, Michael B. (2007) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/375)
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