Information card for entry 7129137

Structure parameters

• Formula: C114 H82 Cl6 N24 O8
• Calculated formula: C114 H82 Cl6 N24 O8
• Title of publication: Emissive oxidase-like nanozyme based on an organic molecular cage.
• Authors of publication: Wang, Zhen; Yang, Bin-Bin; Fang, Zi-Jun; Ou, Qiang; Ma, Hui; Zhang, Qing-Pu; Sun, Yu-Ling; Zhang, Chun
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 87
• Pages of publication: 11541 - 11544
• a: 19.0236 ± 0.0009 Å
• b: 32.8188 ± 0.0016 Å
• c: 18.0034 ± 0.0009 Å
• α: 90°
• β: 94.183 ± 0.002°
• γ: 90°
• Cell volume: 11210.2 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0935
• Residual factor for significantly intense reflections: 0.0818
• Weighted residual factors for significantly intense reflections: 0.255
• Weighted residual factors for all reflections included in the refinement: 0.2705
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 1.34138 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No