Information card for entry 2002999

Structure parameters

• Common name: titanium(IV) oxide phosphate
• Chemical name: Pentatitanium(IV)-tetroxide-tetrakis(phosphate)
• Formula: O20 P4 Ti5
• Calculated formula: O20 P4 Ti4.999
• Title of publication: Ideal and Real Structure of Ti~5~O~4~(PO~4~)~4~: X-ray and HRTEM Investigations
• Authors of publication: Glaum, Robert; Reinauer, Felix
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 6
• Pages of publication: 722 - 731
• a: 12.8417 ± 0.0012 Å
• b: 14.4195 ± 0.0013 Å
• c: 7.4622 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1381.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0569
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for all reflections: 0.143
• Weighted residual factors for significantly intense reflections: 0.1364
• Goodness-of-fit parameter for all reflections: 1.112
• Goodness-of-fit parameter for significantly intense reflections: 1.213
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No