Information card for entry 7239948

Structure parameters

• Formula: C38 H91 O26 P4 Ti6
• Calculated formula: C38 H91 O26 P4 Ti6
• Title of publication: Titanium phosphonate oxo-alkoxide “clusters”: solution stability and facile hydrolytic transformation into nano titania
• Authors of publication: Svensson, Fredric G.; Daniel, Geoffrey; Tai, Cheuk-Wai; Seisenbaeva, Gulaim A.; Kessler, Vadim G.
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 12
• Pages of publication: 6873 - 6883
• a: 13.141 ± 0.003 Å
• b: 14.492 ± 0.004 Å
• c: 19.519 ± 0.008 Å
• α: 96.504 ± 0.004°
• β: 99.449 ± 0.005°
• γ: 113.033 ± 0.003°
• Cell volume: 3309.3 ± 1.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0683
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1019
• Weighted residual factors for all reflections included in the refinement: 0.1076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No