Data Collection: D Gillotta and Samantha K. Callearb

Structure Determination: D Gillotta and Samantha K. Callearb.

Alton collegea
University of Southamptonb



Identification Number:10.5258/ecrystals/642
Date Created:17 February 2009
Deposited On:17 Feb 2009 15:27
Deposited By:Dr Samantha K Callear

Data collection parameters

Chemical formulaC7 H16 O2
Crystal morphologyBlock
Crystal systemmonoclinic
Space group symbolP21/c
Cell length a12.1273(3)
Cell length b11.4724(4)
Cell length c11.5592(4)
Cell angle alpha90.00
Cell angle beta90.735(2)
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0964
R Factor (All)0.1426
Weighted R Factor (Obs)0.1650
Weighted R Factor (All)0.1888

Citation: Gillott, D and Callear, Samantha K. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/642)
Export as: oreChem EndNote BibTeX ASCII Citation

Repository Staff Only: item control page