Information card for entry 7710280

Structure parameters

• Formula: C45 H25 Eu N4 O13
• Calculated formula: C45 H25 Eu N4 O13
• Title of publication: An electron-deficient MOF as an efficient electron-transfer catalyst for selective oxidative carbon–carbon coupling of 2,6-di-tert-butylphenol
• Authors of publication: Liu, Teng; Shen, Xianfu; Liu, Zhengfen; Zhang, Feng; Liu, Jian-Jun
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 38.2925 ± 0.0007 Å
• b: 38.2925 ± 0.0007 Å
• c: 16.4164 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 24071.6 ± 0.9 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0761
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1264
• Weighted residual factors for all reflections included in the refinement: 0.136
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No