Information card for entry 7044014

Structure parameters

• Formula: Cu6.35 Na Sb3
• Calculated formula: Cu6.343 Na Sb2.9999
• Title of publication: Two-Dimensional Metal NaCu6.3Sb3 and Solid-State Transformations of Sodium Copper Antimonides
• Authors of publication: Owens-Baird, Bryan; Lee, Shannon; Kovnir, Kirill
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 4.2166 ± 0.0002 Å
• b: 4.2166 ± 0.0002 Å
• c: 24.0406 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 370.17 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 194
• Hermann-Mauguin space group symbol: P 63/m m c
• Hall space group symbol: -P 6c 2c
• Residual factor for all reflections: 0.0223
• Residual factor for significantly intense reflections: 0.0218
• Weighted residual factors for significantly intense reflections: 0.0485
• Weighted residual factors for all reflections included in the refinement: 0.049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.217
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No