Information card for entry 4349248

Structure parameters

• Formula: C79 H63 Bi N8 P4
• Calculated formula: C79 H63 Bi N8 P4
• SMILES: [Bi](C#N)(C#N)(C#N)(C#N)C#N.P(=N[P+](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.P(=N[P+](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.C(#N)C
• Title of publication: Cyanido Antimonate(III) and Bismuthate(III) Anions.
• Authors of publication: Arlt, Sören; Harloff, Jörg; Schulz, Axel; Stoffers, Alrik; Villinger, Alexander
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 23
• Pages of publication: 12321 - 12328
• a: 9.0391 ± 0.0005 Å
• b: 56.828 ± 0.003 Å
• c: 13.9215 ± 0.0007 Å
• α: 90°
• β: 108.905 ± 0.003°
• γ: 90°
• Cell volume: 6765.4 ± 0.6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.0734
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No