Information card for entry 1572316

Structure parameters

• Formula: C48 H88 Cl6 O26 Sn2 Ti6
• Calculated formula: C48 H88 Cl6 O26 Sn2 Ti6
• Title of publication: Modulated assembly and structural diversity of heterometallic Sn-Ti oxo clusters from inorganic tin precursors
• Authors of publication: Zhao, Hui-Fang; Liu, Fang-Fang; Ding, Qing-Rong; Wang, Di; Zhang, Jian; Zhang, Lei
• Journal of publication: Nanoscale
• Year of publication: 2024
• a: 12.3168 ± 0.0004 Å
• b: 14.0058 ± 0.0004 Å
• c: 15.4344 ± 0.0003 Å
• α: 110.064 ± 0.002°
• β: 92.418 ± 0.002°
• γ: 112.772 ± 0.003°
• Cell volume: 2258.45 ± 0.13 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0687
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.1759
• Weighted residual factors for all reflections included in the refinement: 0.1815
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.3405 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No