Information card for entry 4349623

Structure parameters

• Common name: Cd-glutamate-bpee2
• Chemical name: Compound2
• Formula: C46 H44 Cd3 N10 O17
• Calculated formula: C46 H44 Cd3 N10 O17
• Title of publication: Construction of 3D homochiral metal‒organic frameworks (MOFs) of Cd(ii): selective CO2adsorption and catalytic properties for the Knoevenagel and Henry reaction
• Authors of publication: Ugale, Bharat; Dhankhar, Sandeep Singh; Nagaraja, C. M.
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 2
• Pages of publication: 348
• a: 9.5471 ± 0.0011 Å
• b: 11.7577 ± 0.0012 Å
• c: 14.0097 ± 0.0015 Å
• α: 69.421 ± 0.003°
• β: 87.4 ± 0.004°
• γ: 67.391 ± 0.003°
• Cell volume: 1351.8 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0898
• Weighted residual factors for all reflections included in the refinement: 0.0916
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No