Information card for entry 7126176

Structure parameters

• Formula: C51 H39 N6 O16 Tb2
• Calculated formula: C51 H39 N6 O16 Tb2
• Title of publication: Solvent triggering structural changes for two terbium-based metal-organic frameworks and their photoluminescence sensing.
• Authors of publication: Yue, Dan; Wang, Yanyan; Chen, Dong; Wang, Zhenling
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 31
• Pages of publication: 4320 - 4323
• a: 12.071 ± 0.002 Å
• b: 33.798 ± 0.007 Å
• c: 11.609 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4736.2 ± 1.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0551
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0846
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No