Information card for entry 4115838

Structure parameters

• Common name: nickel bismuth iodide
• Chemical name: nickel bismuth sulphoiodide
• Formula: Bi8 I Ni8 S
• Calculated formula: Bi8 I Ni8 S
• Title of publication: Unique Metallic Wires in a Novel Quasi-1D Compound. Synthesis, Crystal and Electronic Structure, and Properties of Ni8Bi8SI
• Authors of publication: Alexey I. Baranov; Lars A. Kloo; Andrei V. Olenev; Boris A. Popovkin; Anatolii I. Romanenko; Andrei V. Shevelkov
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2001
• Journal volume: 123
• Pages of publication: 12375 - 12379
• a: 9.774 ± 0.001 Å
• b: 9.774 ± 0.001 Å
• c: 4.197 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 400.94 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 75
• Hermann-Mauguin space group symbol: P 4
• Hall space group symbol: P 4
• Residual factor for all reflections: 0.1097
• Residual factor for significantly intense reflections: 0.0671
• Weighted residual factors for significantly intense reflections: 0.1594
• Weighted residual factors for all reflections included in the refinement: 0.178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No