Information card for entry 7003113

Structure parameters

• Formula: C28 H68 N4 O12 Ti4
• Calculated formula: C28 H68 N4 O12 Ti4
• Title of publication: Synthesis and characterisation of new titanium amino-alkoxides: precursors for the formation of TiO2 materials
• Authors of publication: Hollingsworth, Nathan; Kanna, Miki; Kociok-Köhn, Gabriele; Molloy, Kieran C.; Wongnawa, Sumpun
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 5
• Pages of publication: 631 - 641
• a: 9.8514 ± 0.0003 Å
• b: 22.0293 ± 0.0008 Å
• c: 10.831 ± 0.0003 Å
• α: 90°
• β: 117.83 ± 0.002°
• γ: 90°
• Cell volume: 2078.67 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1111
• Residual factor for significantly intense reflections: 0.0844
• Weighted residual factors for significantly intense reflections: 0.2169
• Weighted residual factors for all reflections included in the refinement: 0.242
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No