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Fe~3~H~6~KO~14~S~2~ - Fe3H6KO14S2

Sample Originator: Andrew S. Willsa.

Data Collection: Simon Colesb and Michael B. Hursthouseb

Structure Determination: Simon Colesb.

University College Londona
University of Southamptonb

Fe3H6KO14S2

InChI=1/Fe.K.H2O2S.H2O/c;;1-3-2;/h;;1-2H;1H2/q+2;;;/p-2

Controlled Keywords:magnetic compounds, iron compounds
Date Created:15 December 2004
Deposited On:16 Feb 2010 16:11
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaFe3 H6 K O14 S2
Crystal morphologyBlock
Crystal systemTrigonal
Space group symbolR-3m
Cell length a7.3003(10)
Cell length b7.3003(10)
Cell length c17.216(3)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma120.00
Data collection temperature295(2)

Refinement results

Solution figure of merit0.0305
R Factor (Obs)0.0230
R Factor (All)0.0241
Weighted R Factor (Obs)0.0603
Weighted R Factor (All)0.0609

Citation: Wills, Andrew S. and Coles, Simon and Hursthouse, Michael B. (2004) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1172/)
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