Information card for entry 4030607

Structure parameters

• Formula: Ba2 Ir O6 Sr
• Calculated formula: Ba2 Ir O6 Sr
• SMILES: [Ba+2].[O-][Ir]([O-])([O-])([O-])([O-])[O-].[Sr+2].[Ba+2]
• Title of publication: Stabilization of six-coordinated iridium(VI) in a perovskite oxygen lattice Ba2MIrO6 (M = Ca, Sr)
• Authors of publication: Jung, D.-K.; Gravereau, P.; Demazeau, G.
• Journal of publication: European Journal of Solid State and Inorganic Chemistry
• Year of publication: 1993
• Journal volume: 30
• Pages of publication: 1025 - 1037
• a: 6.025 ± 0.0001 Å
• b: 6.025 ± 0.0001 Å
• c: 6.025 ± 0.0001 Å
• α: 60.48 ± 0.05°
• β: 60.48 ± 0.05°
• γ: 60.48 ± 0.05°
• Cell volume: 156.33 ± 0.1 ų
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 4
• Space group number: 166
• Hermann-Mauguin space group symbol: R -3 m :R
• Hall space group symbol: -P 3* 2
• Residual factor R(I) for significantly intense reflections: 0.033
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No