Information card for entry 7242824

Structure parameters

• Formula: C37 H27 N O10 Th
• Calculated formula: C37 H27 N O10 Th
• Title of publication: Synthesis of luminescent thorium-based metal‒organic frameworks with 1,2,4,5-tetrakis(4-carboxyphenyl)benzene
• Authors of publication: Yu, Ting; Qian, Zheng-hua; Li, Lin; Wu, Xiao-ling; He, Hui; Qiao, Yan-bo; Ye, Guo-an
• Journal of publication: RSC Advances
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 28
• Pages of publication: 17431 - 17436
• a: 12.077 ± 0.0015 Å
• b: 31.421 ± 0.004 Å
• c: 14.83 ± 0.002 Å
• α: 90°
• β: 112.117 ± 0.004°
• γ: 90°
• Cell volume: 5213.5 ± 1.2 ų
• Cell temperature: 190 ± 2 K
• Ambient diffraction temperature: 189.7 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1238
• Residual factor for significantly intense reflections: 0.0949
• Weighted residual factors for significantly intense reflections: 0.2562
• Weighted residual factors for all reflections included in the refinement: 0.2882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No