Information card for entry 4308580

Structure parameters

• Common name: Cd(C~5~H~6~N~2~)~4~NbOF~5~
• Formula: C20 H24 Cd F5 N8 Nb O
• Calculated formula: C20 H24 Cd F5 N8 Nb O
• Title of publication: Examining the Out-of-Center Distortion in the [NbOF5]2- Anion
• Authors of publication: Heather K. Izumi; Janet E. Kirsch; Charlotte L. Stern; Kenneth R. Poeppelmeier
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 884 - 895
• a: 8.4034 ± 0.0004 Å
• b: 8.4034 ± 0.0004 Å
• c: 34.933 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2466.9 ± 0.3 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• Space group number: 78
• Hermann-Mauguin space group symbol: P 43
• Hall space group symbol: P 4cw
• Residual factor for all reflections: 0.0427
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No