Acetic acid 4,5-diacetoxy-6-acetoxymethyl-2-benzylsulfanyl-tetrahydro-pyran-3-yl ester

Sample Originator: Anna K. Crofta.

Data Collection: Graham J. Tizzardb and Michael B. Hursthouseb

Structure Determination: Graham J. Tizzardb and Michael B. Hursthouseb.

University of Wales, Bangora
University of Southamptonb



Identification Number:10.5258/ecrystals/858
Controlled Keywords:organic structures, sugars
Date Created:18 September 2009
Deposited On:16 Feb 2010 11:32
Deposited By:Dr G J Tizzard

Data collection parameters

Chemical formulaC21 H26 O9 S
Crystal morphologyRod
Crystal systemmonoclinic
Space group symbolC 2
Cell length a18.9488(6)
Cell length b5.60240(10)
Cell length c20.7934(6)
Cell angle alpha90.00
Cell angle beta90.355(2)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0617
R Factor (All)0.0869
Weighted R Factor (Obs)0.1100
Weighted R Factor (All)0.1233

Citation: Croft, Anna K. and Tizzard, Graham J. and Hursthouse, Michael B. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/858)
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