Information card for entry 7713358

Structure parameters

• Formula: C31 H33 Cu2 N2 O8
• Calculated formula: C31 H33 Cu2 N2 O8
• Title of publication: An aliphatic MOF with a molecular sieving effect for efficient C₂H₂/C₂H₄ separation.
• Authors of publication: Li, Xianzhen; Cao, Chen; Fan, Ziwen; Liu, Jianfa; Pham, Tony; Forrest, Katherine A.; Niu, Zheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• a: 14.429 ± 0.003 Å
• b: 15.544 ± 0.003 Å
• c: 28.11 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6305 ± 2 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 5
• Space group number: 73
• Hermann-Mauguin space group symbol: I b c a
• Hall space group symbol: -I 2b 2c
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.1157
• Weighted residual factors for all reflections included in the refinement: 0.1204
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No