Information card for entry 4000195

Structure parameters

• Formula: Cl14.23 K1.87 Nb6 O4.78 Ti2
• Calculated formula: Cl14.22 K1.88 Nb6 O4.78 Ti2
• Journal of publication: Chemistry of Materials
• Year of publication: 2002
• a: 21.513 ± 0.005 Å
• b: 8.65 ± 0.002 Å
• c: 15.707 ± 0.003 Å
• α: 90°
• β: 116.805 ± 0.016°
• γ: 90°
• Cell volume: 2608.9 ± 1 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.127
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1048
• Weighted residual factors for all reflections included in the refinement: 0.1261
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No