Information card for entry 7219447

Structure parameters

• Formula: C34 H34 Cd2 N12 O6
• Calculated formula: C34 H34 Cd2 N12 O6
• Title of publication: Luminescent MOF Material based on Cadmium(II) and Mixed Ligands: Application for Sensing Volatile Organic Solvent Molecules
• Authors of publication: Wang, Dongmei; Zhang, Lirong; Li, Guanghua; Huo, Qisheng; Liu, Yunling
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 23.984 ± 0.005 Å
• b: 13.122 ± 0.003 Å
• c: 11.917 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3750.5 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.064
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0844
• Weighted residual factors for all reflections included in the refinement: 0.0919
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No