Information card for entry 1568379

Structure parameters

• Formula: C422 H299 B11.5 F47 N72 O27.75 Zn8
• Calculated formula: C422 H288 B11.75 F47 N72 O27.4999 Zn8
• Title of publication: Highly efficient Förster resonance energy transfer between an emissive tetraphenylethylene-based metal-organic cage and the encapsulated dye guest.
• Authors of publication: Li, Danyang; Liu, Xin; Yang, Linlin; Li, Hechuan; Guo, Guoxu; Li, Xuezhao; He, Cheng
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 8
• Pages of publication: 2237 - 2244
• a: 27.5152 ± 0.0014 Å
• b: 48.566 ± 0.003 Å
• c: 55.058 ± 0.003 Å
• α: 90°
• β: 91.649 ± 0.001°
• γ: 90°
• Cell volume: 73544 ± 7 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.3647
• Residual factor for significantly intense reflections: 0.1153
• Weighted residual factors for significantly intense reflections: 0.2815
• Weighted residual factors for all reflections included in the refinement: 0.3155
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No