Information card for entry 1574645

Structure parameters

• Formula: C98 H104 In4 O70 Ti12
• Calculated formula: C98 H108 In4 O70 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: 19.7706 ± 0.0002 Å
• b: 19.7706 ± 0.0002 Å
• c: 15.9534 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6235.81 ± 0.12 ų
• Cell temperature: 100 ± 0.3 K
• Ambient diffraction temperature: 100 ± 0.3 K
• Number of distinct elements: 5
• Space group number: 114
• Hermann-Mauguin space group symbol: P -4 21 c
• Hall space group symbol: P -4 2n
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.109
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.3405 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No