Information card for entry 7216836

Structure parameters

• Formula: C24 H20 N5 O5 Zn
• Calculated formula: C21 H13 N4 O4 Zn
• Title of publication: Utilising hinged ligands in MOF synthesis: a covalent linking strategy for forming 3D MOFs
• Authors of publication: Coghlan, Campbell J.; Sumby, Christopher J.; Doonan, Christian J.
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 28
• Pages of publication: 6364
• a: 23.269 ± 0.005 Å
• b: 10.602 ± 0.002 Å
• c: 24.34 ± 0.005 Å
• α: 90°
• β: 111.28 ± 0.03°
• γ: 90°
• Cell volume: 5595 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0767
• Residual factor for significantly intense reflections: 0.0706
• Weighted residual factors for significantly intense reflections: 0.1961
• Weighted residual factors for all reflections included in the refinement: 0.2007
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No