Information card for entry 7216838

Structure parameters

• Formula: C13.5 H16.5 Co0.5 N3 O4.5
• Calculated formula: C10.5 H9.5 Co0.5 N2 O3.5
• 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: 10.0477 ± 0.0003 Å
• b: 15.2023 ± 0.001 Å
• c: 22.6589 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3461.1 ± 0.3 ų
• Cell temperature: 109 ± 2 K
• Ambient diffraction temperature: 109 ± 2 K
• Number of distinct elements: 5
• Space group number: 58
• Hermann-Mauguin space group symbol: P n n m
• Hall space group symbol: -P 2 2n
• Residual factor for all reflections: 0.0755
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1698
• Weighted residual factors for all reflections included in the refinement: 0.1791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No