Information card for entry 7131072

Structure parameters

• Formula: C135 H111 F21 N32 O29 S11 Zn4
• Calculated formula: C135 H111 F21 N32 O29 S11 Zn4
• Title of publication: Light-switched selective catalysis with NADH mimic functionalized metal-organic capsules.
• Authors of publication: Wei, Jianwei; Zhao, Liang; Zhang, Yu; Zhou, Peng; Liu, Guangzhou; Duan, Chunying
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2022
• Journal volume: 59
• Journal issue: 1
• Pages of publication: 71 - 74
• a: 19.2588 ± 0.0012 Å
• b: 21.0194 ± 0.0013 Å
• c: 23.1335 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9364.6 ± 1 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 7
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0634
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1357
• Weighted residual factors for all reflections included in the refinement: 0.1438
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No