Information card for entry 4000153

Structure parameters

• Formula: In2 O15 Se6
• Calculated formula: C2 H6 Nb0.5 O4 Re0.5
• SMILES: O=[Re](=O)(=O)O[Nb](OC)(OC)(OC)OC
• Journal of publication: Chemistry of Materials
• Year of publication: 2002
• a: 11.1463 ± 0.0005 Å
• b: 13.321 ± 0.0006 Å
• c: 9.7149 ± 0.0004 Å
• α: 90°
• β: 105.478 ± 0.001°
• γ: 90°
• Cell volume: 1390.15 ± 0.11 ų
• Cell temperature: 293 ± 0.2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 3
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.1419
• Residual factor for significantly intense reflections: 0.0679
• Weighted residual factors for significantly intense reflections: 0.1417
• Weighted residual factors for all reflections included in the refinement: 0.1604
• Goodness-of-fit parameter for all reflections included in the refinement: 0.902
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No