Information card for entry 7237423

Structure parameters

• Formula: C40 H36 N12 O16 P4 Zn3
• Calculated formula: C40 H36 N12 O16 P4 Zn3
• Title of publication: An inorganic‒organic hybrid framework from the assembly of an electron-rich diphosphonate and electron-deficient tripyridyl moiety
• Authors of publication: Ma, Yu-Juan; Han, Song-De; Pan, Jie; Mu, Ying; Li, Jin-Hua; Wang, Guo-Ming
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 35
• Pages of publication: 9341
• a: 10.9781 ± 0.001 Å
• b: 14.0982 ± 0.0011 Å
• c: 16.9572 ± 0.0013 Å
• α: 105.647 ± 0.007°
• β: 108.8 ± 0.008°
• γ: 100.832 ± 0.007°
• Cell volume: 2281.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0874
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.1108
• Weighted residual factors for all reflections included in the refinement: 0.1261
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No