Information card for entry 7703671

Structure parameters

• Formula: C16 H45 Bi2 I9 La O8 S8
• Calculated formula: C16 H45 Bi2 I9 La O8 S8
• SMILES: [Bi]12(I)(I)(I)[I][Bi]([I]1)([I]2)(I)(I)I.[La]([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)([O]=S(C)C)[O]=S(C)C
• Title of publication: Non-transient thermo-/photochromism of iodobismuthate hybrids directed by solvated metal cations.
• Authors of publication: Hao, Pengfei; Wang, Weipin; Shen, Junju; Fu, Yunlong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 6
• Pages of publication: 1847 - 1853
• a: 12.0219 ± 0.0014 Å
• b: 15.8042 ± 0.0019 Å
• c: 16.282 ± 0.002 Å
• α: 82.124 ± 0.003°
• β: 69.973 ± 0.003°
• γ: 78.89 ± 0.003°
• Cell volume: 2843.5 ± 0.6 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1031
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1663
• Weighted residual factors for all reflections included in the refinement: 0.1928
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No