Information card for entry 1568610

Structure parameters

• Formula: C112 H70 N8 O59 Y8
• Calculated formula: C112 H70 N8 O59 Y8
• Title of publication: A 12-Connected [Y₄((<i>μ</i>₃-OH)₄]⁸⁺ Cluster-Based Luminescent Metal-Organic Framework for Selective Turn-on Detection of F^- in H₂O.
• Authors of publication: Li, Juan; Wang, Airong; Qiu, Shiming; Wang, Xiaoli; Li, Jiaming
• Journal of publication: Molecules (Basel, Switzerland)
• Year of publication: 2023
• Journal volume: 28
• Journal issue: 4
• Pages of publication: 1893
• a: 33.7993 ± 0.001 Å
• b: 33.7993 ± 0.001 Å
• c: 7.9398 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9070.4 ± 0.7 ų
• Cell temperature: 298.15 K
• Ambient diffraction temperature: 298.15 K
• Number of distinct elements: 5
• Space group number: 113
• Hermann-Mauguin space group symbol: P -4 21 m
• Hall space group symbol: P -4 2ab
• Residual factor for all reflections: 0.1419
• Residual factor for significantly intense reflections: 0.1209
• Weighted residual factors for significantly intense reflections: 0.3069
• Weighted residual factors for all reflections included in the refinement: 0.3291
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No