Information card for entry 7707390

Structure parameters

• Formula: C44 H44 Cu N4 O8
• Calculated formula: C44 H44 Cu N4 O8
• Title of publication: Flexible and porous 2D layered structures based on mixed-linker metal-organic frameworks for gas sorption studies.
• Authors of publication: Dissem, Nour; Essalhi, Mohamed; Ferhi, Najmeddine; Abidi, Adela; Maris, Thierry; Duong, Adam
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 25
• Pages of publication: 8727 - 8735
• a: 7.5883 ± 0.0004 Å
• b: 9.4777 ± 0.0005 Å
• c: 16.8623 ± 0.001 Å
• α: 81.516 ± 0.002°
• β: 80.992 ± 0.002°
• γ: 72.616 ± 0.002°
• Cell volume: 1136.51 ± 0.11 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0343
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No