Information card for entry 1577485

Structure parameters

• Formula: C32 H19 Cd F6 N4 O7
• Calculated formula: C32 H19 Cd F6 N4 O7
• Title of publication: Cooperativity and Anticooperativity Effects in a Cadmium-Based Metal−Organic Framework: Structural Characterization, Non-Covalent Interaction Analysis, and Catalytic Activity
• Authors of publication: Sadhukhan, Arijit; Mal, Dasarath; Maity, Buddhadev; Mahapatra, Debadyuti; Maity, Tanmoy; Brandao, Paula; Das, Asit Kumar; Roy Choudhury, Chirantan; Bhaumik, Prasanta Kumar; Frontera, Antonio
• Journal of publication: Langmuir
• Year of publication: 2026
• Journal volume: 42
• Journal issue: 20
• Pages of publication: 14128 - 14141
• a: 15.3475 ± 0.0005 Å
• b: 9.1455 ± 0.0004 Å
• c: 21.6383 ± 0.0007 Å
• α: 90°
• β: 102.688 ± 0.003°
• γ: 90°
• Cell volume: 2963 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0859
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1262
• Weighted residual factors for all reflections included in the refinement: 0.1465
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No