Information card for entry 7041966

Structure parameters

• Formula: C102 H108 N10 O20 Zn2
• Calculated formula: C92 H86 N8 O18 Zn2
• Title of publication: Metal-organic frameworks utilising an interlocked, hexadentate linker containing a tetra-carboxylate axle and a bis(pyridine) wheel.
• Authors of publication: Gholami, Ghazale; Baggi, Giorgio; Zhu, Kelong; Loeb, Stephen J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 8
• Pages of publication: 2462 - 2470
• a: 11.4221 ± 0.0004 Å
• b: 21.2742 ± 0.0008 Å
• c: 19.0647 ± 0.0007 Å
• α: 90°
• β: 95.4192 ± 0.0019°
• γ: 90°
• Cell volume: 4611.9 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0889
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.1795
• Weighted residual factors for all reflections included in the refinement: 0.1957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No