Information card for entry 4324351

Structure parameters

• Common name: Neptunium sulfide
• Formula: Np3 S5
• Calculated formula: Np3 S5
• SMILES: [Np+4].[Np+3].[Np+3].[S-2].[S-2].[S-2].[S-2].[S-2]
• Title of publication: Syntheses, Structures, and Magnetic Properties of Np3S5 and Np3Se5
• Authors of publication: Geng Bang Jin; S. Skanthakumar; Richard G. Haire; L. Soderholm; James A. Ibers
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 1084 - 1088
• a: 11.7435 ± 0.0006 Å
• b: 8.0479 ± 0.0004 Å
• c: 7.4108 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 700.4 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 2
• 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: 0.0197
• Residual factor for significantly intense reflections: 0.0183
• Weighted residual factors for significantly intense reflections: 0.04
• Weighted residual factors for all reflections included in the refinement: 0.0405
• Goodness-of-fit parameter for all reflections included in the refinement: 1.451
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No