Information card for entry 1574648

Structure parameters

• Formula: C106 H114 In4 O66 Ti12
• Calculated formula: C106 H114 In4 O66 Ti12
• Title of publication: Ligand effect on In-Ti-oxo nanoclusters for nanolithography.
• Authors of publication: Wu, Jiao; Chen, Jiali; Wang, Liming; Ye, Yuting; Zhan, Xiaozhi; Song, Yihang; Li, Qiao-Hong; Yi, Xiaofeng; Zhang, Jian
• Journal of publication: Materials horizons
• Year of publication: 2025
• Journal volume: 12
• Journal issue: 16
• Pages of publication: 6283 - 6290
• a: 26.2798 ± 0.0002 Å
• b: 20.9981 ± 0.0002 Å
• c: 31.0613 ± 0.0003 Å
• α: 90°
• β: 107.447 ± 0.001°
• γ: 90°
• Cell volume: 16351.9 ± 0.3 ų
• Cell temperature: 120 ± 0.3 K
• Ambient diffraction temperature: 120 ± 0.3 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0732
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1573
• Weighted residual factors for all reflections included in the refinement: 0.1675
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.3405 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No