3-Furoic acid - C5H4O3

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/377
Date Created:02 October 2007
Deposited On:31 Jan 2008 13:07
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 formulaC5 H4 O3
Crystal morphologyPlate
Crystal systemMonoclinic
Space group symbolP2(1)/c
Cell length a5.1078(4)
Cell length b5.8535(5)
Cell length c16.0142(14)
Cell angle alpha90.00
Cell angle beta90.624(5)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0376
R Factor (Obs)0.0407
R Factor (All)0.0689
Weighted R Factor (Obs)0.0939
Weighted R Factor (All)0.1048

Citation: Sample, Donated and Huth, Susanne L. and Hursthouse, Michael B. (2007) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/377)
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