Information card for entry 7106966

Structure parameters

• Formula: C81 H57 N3 O30 Zn8
• Calculated formula: C81 H57 N3 O30 Zn8
• Title of publication: A Zn4O-containing doubly interpenetrated porous metal-organic framework for photocatalytic decomposition of methyl orange
• Authors of publication: Madhab C. Das; Hui Xu; Zhiyu Wang; Gadipelli Srinivas; Wei Zhou; Yan-Feng Yue; Vladimir N. Nesterov; Guodong Qian; Banglin Chen
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 11715
• a: 17.672 ± 0.006 Å
• b: 19.85 ± 0.007 Å
• c: 20.915 ± 0.007 Å
• α: 72.383 ± 0.004°
• β: 70.947 ± 0.005°
• γ: 69.724 ± 0.005°
• Cell volume: 6355 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1351
• Residual factor for significantly intense reflections: 0.0981
• Weighted residual factors for significantly intense reflections: 0.2371
• Weighted residual factors for all reflections included in the refinement: 0.2521
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No