Information card for entry 7042315

Structure parameters

• Formula: Cs3 O29 P7 Ti5
• Calculated formula: Cs3 O29 P7 Ti5
• Title of publication: Cs3Ti5P7O29 : a titanium(IV) phosphate containing TiO5 trigonal bipyramids
• Authors of publication: Lii, Kwang-Hwa
• Journal of publication: Journal of the Chemichal Society, Dalton Transactions
• Year of publication: 1995
• Pages of publication: 927 - 930
• a: 6.307 ± 0.001 Å
• b: 10.33 ± 0.002 Å
• c: 20.23 ± 0.003 Å
• α: 88.65 ± 0.01°
• β: 84.83 ± 0.01°
• γ: 72.37 ± 0.01°
• Cell volume: 1251 ± 0.4 ų
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for significantly intense reflections: 0.0451
• Goodness-of-fit parameter for all reflections included in the refinement: 1.32
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No