(6-methyltetrahydro-2H-pyran-2-yl)acetic acid

Sample Originator: Adrian Dobbsa.

Data Collection: Simon J. Colesb and Michael B. Hursthouseb

Structure Determination: Simon J. Colesb.

Queen Mary, University of Londona
University of Southamptonb



Identification Number:10.5258/ecrystals/1000
Controlled Keywords:carboxylic acids
Date Created:11 March 2003
Deposited On:17 Dec 2009 15:31
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaC8 H14 O3
Crystal morphology
Crystal systemTriclinic
Space group symbolP-1
Cell length a6.8220(2)
Cell length b8.2332(2)
Cell length c8.7991(3)
Cell angle alpha64.2870(10)
Cell angle beta75.3220(10)
Cell angle gamma77.259(2)
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0570
R Factor (All)0.0660
Weighted R Factor (Obs)0.1558
Weighted R Factor (All)0.1622

Citation: Dobbs, Adrian and Coles, Simon J. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1000)
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