Information card for entry 9013993

Structure parameters

• Formula: Fe3 H30 O12.236 S0.5
• Calculated formula: Fe3 O12.236 S0.5
• SMILES: [Fe+2].[Fe+2].[Fe+2].[Fe+2].[Fe+3].[Fe+3].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].S(=O)(=O)([O-])[O-].O.O.O.O.O.O.O.O
• Title of publication: Structure of Fe(II-III) layered double hydroxysulphate green rust two from Rietveld analysis Locality: synthetic
• Authors of publication: Simon, L.; Francois, M.; Refait, P.; Renaudin, G.; Lelaurain, M.; Genin, J. M. R.
• Journal of publication: Solid State Sciences
• Year of publication: 2003
• Journal volume: 5
• Pages of publication: 327 - 334
• a: 5.5241 Å
• b: 5.5241 Å
• c: 11.0113 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 291 ų
• Number of distinct elements: 4
• Space group number: 162
• Hermann-Mauguin space group symbol: P -3 1 m
• Hall space group symbol: -P 3 2
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No