Information card for entry 4315551

Structure parameters

• Formula: Cl6 Cs5 Fe O13 V5
• Calculated formula: Cl6 Cs5 Fe O13 V5
• Title of publication: Molten Salt Synthesis and Structural Characterization of Novel Salt-Inclusion Vanadium Bronze Cs5FeV5O13Cl6
• Authors of publication: Parisa Mahjoor; Susan E. Latturner
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 4486 - 4490
• a: 10.943 ± 0.004 Å
• b: 10.943 ± 0.004 Å
• c: 10.535 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1261.6 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 129
• Hermann-Mauguin space group symbol: P 4/n m m :2
• Hall space group symbol: -P 4a 2a
• Residual factor for all reflections: 0.0419
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.0713
• Goodness-of-fit parameter for all reflections included in the refinement: 1.177
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No