Information card for entry 1574754

Structure parameters

• Chemical name: [Ce24O28(OH)8(OOCPhMe)30(Py)4]2(Py)53
• Formula: C365 H335 Ce24 N25 O96
• Calculated formula: C365 H335 Ce24 N25 O96
• Title of publication: Photoabsorption of 1–2 nm molecular Ce-oxo nanoclusters versus ceria: intervalence charge transfer but no size effects
• Authors of publication: Brown, Stephen E.; Pike, Sebastian D.
• Journal of publication: Chemical Science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 25
• Pages of publication: 11659 - 11668
• a: 23.5031 ± 0.0002 Å
• b: 24.4019 ± 0.0002 Å
• c: 32.8406 ± 0.0003 Å
• α: 90.467 ± 0.0007°
• β: 95.3987 ± 0.0008°
• γ: 91.1491 ± 0.0007°
• Cell volume: 18746.5 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0821
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for all reflections: 0.1331
• Weighted residual factors for significantly intense reflections: 0.1174
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9635
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No