Information card for entry 7224797

Structure parameters

• Formula: C24 H16 N4 O4 Zn
• Calculated formula: C24 H16 N4 O4 Zn
• Title of publication: Selective CO2adsorption in four zinc(ii)-based metal organic frameworks constructed using a rigid N,N′-donor linker and various dicarboxylate ligands
• Authors of publication: Parshamoni, Srinivasulu; Konar, Sanjit
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 23
• Pages of publication: 4395
• a: 8.7117 ± 0.0012 Å
• b: 11.0488 ± 0.0016 Å
• c: 13.293 ± 0.0019 Å
• α: 69.79 ± 0.004°
• β: 77.976 ± 0.004°
• γ: 71.66 ± 0.004°
• Cell volume: 1132.6 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0594
• Weighted residual factors for significantly intense reflections: 0.1421
• Weighted residual factors for all reflections included in the refinement: 0.1421
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No