Information card for entry 7236098

Structure parameters

• Chemical name: 3,3',5,5'-tetrakis(p-carboxyphenyl)-2,2',6,6'-tetramethoxy-1,1'-biphenyl
• Formula: C44 H30 Cd0.87 Mn0.63 O12
• Calculated formula: C44 H30 Cd0.871 Mn0.629 O12
• Title of publication: Diverse isostructural MOFs by postsynthetic metal node metathesis: anionic-to-cationic framework conversion, luminescence and separation of dyes
• Authors of publication: Seth, Soana; Savitha, Govardhan; Moorthy, Jarugu Narasimha
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2015
• Journal volume: 3
• Journal issue: 45
• Pages of publication: 22915
• a: 15.957 ± 0.004 Å
• b: 16.46 ± 0.004 Å
• c: 17.3 ± 0.005 Å
• α: 106.07 ± 0.006°
• β: 100.85 ± 0.005°
• γ: 113.408 ± 0.005°
• Cell volume: 3770.9 ± 1.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.2675
• Residual factor for significantly intense reflections: 0.1472
• Weighted residual factors for significantly intense reflections: 0.3403
• Weighted residual factors for all reflections included in the refinement: 0.401
• Goodness-of-fit parameter for all reflections included in the refinement: 1.131
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No