Information card for entry 7129114

Structure parameters

• Formula: C20 H16 I2 O11 Zn2
• Calculated formula: C20 H16 I2 O11 Zn2
• Title of publication: Stabilization of Radical Active Species in a MOF Nanospace to Exploit Unique Reaction Pathways
• Authors of publication: Harada, Yuki; Kusaka, Shinpei; Nakajo, Toshinobu; Kumagai, Jun; Kim, Cho Rong; Shim, Joo Young; Hori, Akihiro; Ma, Yunsheng; Matsuda, Ryotaro
• Journal of publication: Chemical Communications
• Year of publication: 2021
• a: 27.561 ± 0.001 Å
• b: 27.561 ± 0.001 Å
• c: 17.9581 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 11813.6 ± 0.7 ų
• Cell temperature: 233 K
• Ambient diffraction temperature: 233 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1167
• Residual factor for significantly intense reflections: 0.1068
• Weighted residual factors for significantly intense reflections: 0.3737
• Weighted residual factors for all reflections included in the refinement: 0.3887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.823
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No