Information card for entry 2239179

Structure parameters

• Chemical name: Nickel(II) uranium(IV) trisulfide
• Formula: Ni S3 U
• Calculated formula: Ni S3 U
• Title of publication: Nickel(II) uranium(IV) trisulfide
• Authors of publication: Ward, Matthew D.; Ibers, James A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 1
• Pages of publication: i4
• a: 6.8924 ± 0.0003 Å
• b: 8.757 ± 0.0004 Å
• c: 6.0758 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 366.72 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0187
• Residual factor for significantly intense reflections: 0.0181
• Weighted residual factors for significantly intense reflections: 0.0427
• Weighted residual factors for all reflections included in the refinement: 0.0429
• Goodness-of-fit parameter for all reflections included in the refinement: 1.356
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes