Information card for entry 4337286

Structure parameters

• Common name: Lithium Sodium Germanide
• Formula: Ge17 Li18 Na2
• Calculated formula: Ge17 Li18 Na2
• SMILES: [Ge].[Ge]12[Ge]3[Ge]1[Ge]23.[Ge]12[Ge]3[Ge]4[Ge]5[Ge]6[Ge]2[Ge]6[Ge]2[Ge]([Ge]2[Ge]13)[Ge]45.[Li+].[Li+].[Li+].[Li+].[Li+].[Na+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+].[Na+].[Li+].[Li+].[Li+].[Li+].[Li+].[Li+]
• Title of publication: Li18Na2Ge17-A Compound Demonstrating Cation Effects on Cluster Shapes and Crystal Packing in Ternary Zintl Phases.
• Authors of publication: Scherf, Lavinia M.; Zeilinger, Michael; Fässler, Thomas F
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 4
• Pages of publication: 2096 - 2101
• a: 17.0905 ± 0.0004 Å
• b: 17.0905 ± 0.0004 Å
• c: 8.0783 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2043.43 ± 0.08 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 3
• Space group number: 157
• Hermann-Mauguin space group symbol: P 3 1 m
• Hall space group symbol: P 3 -2
• Residual factor for all reflections: 0.0212
• Residual factor for significantly intense reflections: 0.0185
• Weighted residual factors for significantly intense reflections: 0.0412
• Weighted residual factors for all reflections included in the refinement: 0.042
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No