Information card for entry 4030266

Structure parameters

• Formula: Nb2 Pb1.14 S5.14
• Calculated formula: Nb2 Pb1.08 S5.08
• Title of publication: Preparation, structure determination and transport properties of a new misfit layer compound : (PbS1.14)(NbS2)2
• Authors of publication: Meerschaut, A.; Guemas, L.; Auriel, C.; Rouxel, J.
• Journal of publication: European Journal of Solid State and Inorganic Chemistry
• Year of publication: 1990
• Journal volume: 27
• Pages of publication: 557 - 570
• a: 3.3263 ± 0.0009 Å
• b: 5.776 ± 0.002 Å
• c: 35.876 ± 0.013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 689.3 ± 0.4 ų
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No