Information card for entry 4334939

Structure parameters

• Formula: C72 H60 Bi N18 P3
• Calculated formula: C72 H60 Bi N18 P3
• Title of publication: Solid State Structure of Bi(N3)3, Bi(N3)3.Solvates and the Structural Dynamics in the [Bi(N3)6]3- Anion
• Authors of publication: Kati Rosenstengel; Axel Schulz; Alexander Villinger
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 6110 - 6126
• a: 13.3548 ± 0.0002 Å
• b: 22.6623 ± 0.0004 Å
• c: 22.0421 ± 0.0003 Å
• α: 90°
• β: 96.907 ± 0.001°
• γ: 90°
• Cell volume: 6622.64 ± 0.18 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0824
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0592
• Weighted residual factors for all reflections included in the refinement: 0.0704
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No