Information card for entry 4334946

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: 13.4171 ± 0.0006 Å
• b: 22.7304 ± 0.001 Å
• c: 22.1531 ± 0.0009 Å
• α: 90°
• β: 97.03 ± 0.002°
• γ: 90°
• Cell volume: 6705.4 ± 0.5 ų
• Cell temperature: 253 ± 2 K
• Ambient diffraction temperature: 253 ± 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: 0.0886
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0678
• Weighted residual factors for all reflections included in the refinement: 0.0799
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No