Information card for entry 7249214

Structure parameters

• Formula: C38 H47 Cu N5 O8
• Calculated formula: C38 H47 Cu N5 O8
• Title of publication: Functionalization of a porous copper(ii) metal–organic framework and its capacity for loading and delivery of ibuprofen
• Authors of publication: Tella, Adedibu C.; Olatunji, Sunday J.; Ajibade, Peter A.
• Journal of publication: RSC Advances
• Year of publication: 2024
• Journal volume: 14
• Journal issue: 35
• Pages of publication: 25759 - 25770
• a: 12.697 ± 0.0011 Å
• b: 16.0824 ± 0.0015 Å
• c: 18.3656 ± 0.0016 Å
• α: 90°
• β: 94.885 ± 0.003°
• γ: 90°
• Cell volume: 3736.6 ± 0.6 ų
• Cell temperature: 100.07 K
• Ambient diffraction temperature: 100.07 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0505
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.1292
• Weighted residual factors for all reflections included in the refinement: 0.1309
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No