Information card for entry 7245650

Structure parameters

• Formula: C255 H287 Cu8 N37 O51
• Calculated formula: C255 H259 Cu8 N37 O51
• Title of publication: A series of entangled MOFs constructed from flexible dipyridyl piperazine and rigid dicarboxylate: interpenetration, self-penetration and polycatenation
• Authors of publication: Ju, Huiyeong; Kim, Seulgi; Jung, Jong Hwa; Lee, Shim Sung
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 18.2794 ± 0.0005 Å
• b: 29.9253 ± 0.0008 Å
• c: 13.2838 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7266.5 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1149
• Residual factor for significantly intense reflections: 0.0721
• Weighted residual factors for significantly intense reflections: 0.1883
• Weighted residual factors for all reflections included in the refinement: 0.216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No