Information card for entry 7120501

Structure parameters

• Formula: C496 H376 Cu24 N8 O224
• Calculated formula: C496 H376 Cu24 N8 O224
• Title of publication: Reversible Photoreduction of Cu(II)-Coumarin Metal-Organic Polyhedra
• Authors of publication: Bae, Jaeyeon; Baek, Kangkyun; Yuan, Daqiang; Kim, Wooram; Kim, Kimoon; Zhou, Hong-Cai; Park, Jinhee
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 35.309 ± 0.003 Å
• b: 35.309 ± 0.003 Å
• c: 43.609 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 54368 ± 8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 87
• Hermann-Mauguin space group symbol: I 4/m
• Hall space group symbol: -I 4
• Residual factor for all reflections: 0.1418
• Residual factor for significantly intense reflections: 0.0674
• Weighted residual factors for significantly intense reflections: 0.1714
• Weighted residual factors for all reflections included in the refinement: 0.2527
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No