Information card for entry 1572311

Structure parameters

• Formula: C72 H142 Cl18 O50 Sn6 Ti10
• Calculated formula: C72 H142 Cl18 O50 Sn6 Ti10
• 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: 12.9762 ± 0.0002 Å
• b: 22.6922 ± 0.0003 Å
• c: 26.2336 ± 0.0003 Å
• α: 111.513 ± 0.001°
• β: 96.002 ± 0.001°
• γ: 96.357 ± 0.001°
• Cell volume: 7053.79 ± 0.18 ų
• Cell temperature: 100 ± 0.3 K
• Ambient diffraction temperature: 100 ± 0.3 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: 0.0513
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1061
• Weighted residual factors for all reflections included in the refinement: 0.1107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.3405 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No