Information card for entry 2312819

Structure parameters

• Chemical name: Tin(IV) Dilead Oxide
• Formula: O4 Pb2 Sn
• Calculated formula: O4 Pb2 Sn
• Title of publication: Pressure-induced Pb-Pb bonding and phase transition in Pb₂SnO₄.
• Authors of publication: Spahr, Dominik; Stękiel, Michał; Zimmer, Dominik; Bayarjargal, Lkhamsuren; Bunk, Katja; Morgenroth, Wolfgang; Milman, Victor; Refson, Keith; Jochym, Dominik; Byrne, Peter J. P.; Winkler, Björn
• Journal of publication: Acta crystallographica Section B, Structural science, crystal engineering and materials
• Year of publication: 2020
• Journal volume: 76
• Journal issue: Pt 6
• Pages of publication: 979 - 991
• a: 8.7276 ± 0.0002 Å
• b: 8.7276 ± 0.0002 Å
• c: 6.297 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 479.65 ± 0.02 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 135
• Hermann-Mauguin space group symbol: P 42/m b c
• Hall space group symbol: -P 4c 2ab
• Residual factor for all reflections: 0.0303
• Residual factor for significantly intense reflections: 0.0214
• Weighted residual factors for significantly intense reflections: 0.0231
• Weighted residual factors for all reflections included in the refinement: 0.0247
• Goodness-of-fit parameter for significantly intense reflections: 1.27
• Goodness-of-fit parameter for all reflections included in the refinement: 1.26
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No