Information card for entry 2021388

Structure parameters

• Chemical name: Tetrakis(3,4,5-trimethylimidazolium) di-μ~3~-iodido-tetra-μ~2~-iodido-decaiodidotetrabismuth(III)
• Formula: C24 H44 Bi4 I16 N8
• Calculated formula: C24 H44 Bi4 I16 N8
• SMILES: [Bi]12(I)(I)(I)[I][Bi]34(I)(I)[I]1[Bi]1(I)(I)([I]2)[I]3[Bi](I)(I)(I)([I]1)[I]4.n1(C)cc[n+](C)c1C.n1(C)cc[n+](C)c1C.n1(C)cc[n+](C)c1C.n1(C)cc[n+](C)c1C
• Title of publication: Low-dimensional bismuth(III) iodide hybrid material with high activity for the fast removal of rhodamine B
• Authors of publication: Chen, Wei-Jun; Chu, Kai-Bin; Song, Jun-Ling
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 12
• a: 13.1008 ± 0.0008 Å
• b: 13.2084 ± 0.0008 Å
• c: 19.3147 ± 0.0012 Å
• α: 90°
• β: 90.701 ± 0.002°
• γ: 90°
• Cell volume: 3342 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0388
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.0619
• Weighted residual factors for all reflections included in the refinement: 0.0673
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes