Information card for entry 7231915

Structure parameters

• Formula: C29 H25 Cd N5 O7
• Calculated formula: C29 H25 Cd N5 O7
• Title of publication: Two 2D microporous MOFs based on bent carboxylates and a linear spacer for selective CO2 adsorption
• Authors of publication: Pal, Arun; Mitra, Antarip; Chand, Santanu; Lin, Jian-Bin; Das, Madhab C.
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 3
• Pages of publication: 535
• a: 9.949 ± 0.005 Å
• b: 11.344 ± 0.005 Å
• c: 12.395 ± 0.005 Å
• α: 98.565 ± 0.005°
• β: 90.042 ± 0.005°
• γ: 91.149 ± 0.005°
• Cell volume: 1383 ± 1.1 ų
• Cell temperature: 298 ± 1 K
• Ambient diffraction temperature: 298 ± 1 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: 0.1283
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.0977
• Weighted residual factors for all reflections included in the refinement: 0.1266
• Goodness-of-fit parameter for all reflections included in the refinement: 0.961
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No