Information card for entry 7058072

Structure parameters

• Formula: C34 H18 Co O10
• Calculated formula: C34 H18 Co O10
• Title of publication: Construction of a 3D porous Co(ii) metal‒organic framework (MOF) with Lewis acidic metal sites exhibiting selective CO2 capture and conversion under mild conditions
• Authors of publication: Dhankhar, Sandeep Singh; Nagaraja, C. M.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 5
• Pages of publication: 2163
• a: 10.668 ± 0.005 Å
• b: 29.772 ± 0.005 Å
• c: 15.94 ± 0.005 Å
• α: 90 ± 0.005°
• β: 98.866 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 5002 ± 3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.1796
• Residual factor for significantly intense reflections: 0.0851
• Weighted residual factors for significantly intense reflections: 0.2197
• Weighted residual factors for all reflections included in the refinement: 0.2512
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No