Information card for entry 7713551

Structure parameters

• Formula: C24 H25 N5 O4 Zn
• Calculated formula: C24 H25 N5 O4 Zn
• Title of publication: Amine decorated MOF for Direct Capture of CO2 from Ambient Air
• Authors of publication: Gupta, Mayank; Daoo, Varad; Singh, Jayant K.
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 34.992 ± 0.005 Å
• b: 17.836 ± 0.005 Å
• c: 21.716 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 13553 ± 5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 64
• Hermann-Mauguin space group symbol: C m c e
• Hall space group symbol: -C 2ac 2
• Residual factor for all reflections: 0.1525
• Residual factor for significantly intense reflections: 0.0948
• Weighted residual factors for significantly intense reflections: 0.2696
• Weighted residual factors for all reflections included in the refinement: 0.3174
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No