Information card for entry 4344105

Structure parameters

• Formula: Ca5 Ge6 Pd6
• Calculated formula: Ca5 Ge6 Pd6
• Title of publication: Synthesis, Crystal Structure, and Bonding Analysis of the Hypoelectronic Cubic Phase Ca5Pd6Ge6.
• Authors of publication: Doverbratt, Isa; Ponou, Siméon; Wang, Fei; Lidin, Sven
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 18
• Pages of publication: 9098 - 9104
• a: 8.7764 ± 0.0004 Å
• b: 8.7764 ± 0.0004 Å
• c: 8.7764 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 676 ± 0.05 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 229
• Hermann-Mauguin space group symbol: I m -3 m
• Hall space group symbol: -I 4 2 3
• Residual factor for all reflections: 0.016
• Residual factor for significantly intense reflections: 0.0158
• Weighted residual factors for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections included in the refinement: 0.0478
• Goodness-of-fit parameter for significantly intense reflections: 1.82
• Goodness-of-fit parameter for all reflections included in the refinement: 1.8
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No