Information card for entry 1000351

Structure parameters

• Chemical name: Iron phosphate fluoride hydroxide hydrate (1.2/1/0.5/0.2/0.4)
• Formula: F0.45 Fe1.21 H0.92 O4.55 P
• Calculated formula: F0.45 Fe1.212 H0.23 O4.55 P
• Title of publication: Crystal structure and magnetic study of a new iron(III) phosphate, Fe~1.21~PO~4~X (X=F, OH, H~2~O), isostructural with 3MgSO~4~ . Mg(OH)~2~ . H~2~O
• Authors of publication: Loiseau, Th; Lacorre, Ph; Calage, Y; Greneche, J M; Ferey, G
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 1993
• Journal volume: 105
• Pages of publication: 417 - 427
• a: 5.184 ± 0.001 Å
• b: 5.184 ± 0.001 Å
• c: 13.04 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 350.4 ų
• Number of distinct elements: 5
• Space group number: 141
• Hermann-Mauguin space group symbol: I 41/a m d :2
• Hall space group symbol: -I 4bd 2
• Residual factor for all reflections: 0.02
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No