Information card for entry 2220657

Structure parameters

• Chemical name: Chromium Niobium Sulfide
• Formula: Cr0.7 Nb1.3 S5
• Calculated formula: Cr0.7 Nb1.3 S5
• Title of publication: Nb~1.30~Cr~0.70~S~5~: a layered ternary mixed-metal sulfide
• Authors of publication: Yun, Hoseop; Kim, Gangbeom
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 1
• Pages of publication: i1
• a: 8.7938 ± 0.0014 Å
• b: 3.3638 ± 0.0005 Å
• c: 9.9565 ± 0.0016 Å
• α: 90°
• β: 115.193 ± 0.003°
• γ: 90°
• Cell volume: 266.5 ± 0.07 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 3
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0574
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 1.181
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes