Information card for entry 7245647

Structure parameters

• Formula: C38 H38 Cd N6 O4
• Calculated formula: C38 H38 Cd N6 O4
• 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: 16.7798 ± 0.0006 Å
• b: 16.7798 ± 0.0006 Å
• c: 28.3067 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6902.3 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 154
• Hermann-Mauguin space group symbol: P 32 2 1
• Hall space group symbol: P 32 2"
• Residual factor for all reflections: 0.0756
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.0965
• Weighted residual factors for all reflections included in the refinement: 0.1071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No