Information card for entry 7047734

Structure parameters

• Chemical name: Lead Iron Phosphate Fluoride
• Formula: F2 Fe O4 P Pb
• Calculated formula: F2 Fe O4 P Pb
• Title of publication: PbFePO₄F₂ with a 1/6th bond depleted triangular lattice.
• Authors of publication: Lu, Hongcheng; Kageyama, Hiroshi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 43
• Pages of publication: 15303 - 15306
• a: 5.257 ± 0.002 Å
• b: 12.404 ± 0.005 Å
• c: 7.098 ± 0.003 Å
• α: 90°
• β: 102.765 ± 0.009°
• γ: 90°
• Cell volume: 451.4 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0394
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0679
• Weighted residual factors for all reflections included in the refinement: 0.0696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No