Information card for entry 7236084

Structure parameters

• Chemical name: 3,3',5,5'-tetrakis(p-carboxyphenyl)-2,2',6,6'-tetramethoxy-1,1'-biphenyl
• Formula: C97 H81 Cd1.43 N3 O27 Pr1.57
• Calculated formula: C97 H81 Cd1.427 N3 O27 Pr1.573
• 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: 15.89 ± 0.005 Å
• b: 18.596 ± 0.006 Å
• c: 28.5 ± 0.01 Å
• α: 101.979 ± 0.006°
• β: 94.414 ± 0.006°
• γ: 108.931 ± 0.005°
• Cell volume: 7697 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1615
• Residual factor for significantly intense reflections: 0.1031
• Weighted residual factors for significantly intense reflections: 0.2673
• Weighted residual factors for all reflections included in the refinement: 0.3111
• Goodness-of-fit parameter for all reflections included in the refinement: 0.922
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No