Information card for entry 4519072

Structure parameters

• Formula: C62 H40 Cu3 N7 O24 P3
• Calculated formula: C62 H40 Cu3 N7 O24 P3
• Title of publication: Synthesis, Structures, and Sorption Properties of Two New Metal-Organic Frameworks Constructed by the Polycarboxylate Ligand Derived from Cyclotriphosphazene.
• Authors of publication: Han, Jing-Hua; Hu, Bing-Qian; Li, Tangming; Liang, Hao; Yu, Fan; Zhao, Qiang; Li, Bao
• Journal of publication: ACS omega
• Year of publication: 2021
• Journal volume: 6
• Journal issue: 36
• Pages of publication: 23110 - 23116
• a: 16.652 ± 0.0012 Å
• b: 33.684 ± 0.002 Å
• c: 16.5376 ± 0.0012 Å
• α: 90°
• β: 90.498 ± 0.001°
• γ: 90°
• Cell volume: 9275.7 ± 1.1 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 6
• 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: 0.0586
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.14
• Weighted residual factors for all reflections included in the refinement: 0.1469
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No