Information card for entry 7057124

Structure parameters

• Formula: C34 H48 Bi4 I16 N4
• Calculated formula: C34 H48 Bi4 I16 N4
• Title of publication: Black hybrid iodobismuthate containing linear anionic chains
• Authors of publication: Kotov, Vitalii Yu.; Ilyukhin, Andrey B.; Korlyukov, Alexander A.; Smol’yakov, Alexander F.; Kozyukhin, Sergey A.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 8
• Pages of publication: 6354
• a: 16.8086 ± 0.0009 Å
• b: 12.0003 ± 0.0006 Å
• c: 17.7036 ± 0.0009 Å
• α: 90°
• β: 107.294 ± 0.002°
• γ: 90°
• Cell volume: 3409.5 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0563
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No