Information card for entry 7201310

Structure parameters

• Common name: ((C2H5)4N) Eu (C12H8N2)2 (C28H20S4O16) 5H2O
• Formula: C60 H66 Eu N5 O21 S4
• Calculated formula: C60 H32 Eu N5 O16 S4
• Title of publication: 3D metal–organic frameworks incorporating water-soluble tetra-p-sulfonatocalix[4]arene
• Authors of publication: Liao, Wuping; Liu, Ce; Wang, Xiaofei; Zhu, Guangshan; Zhao, Xiaojun; Zhang, Hongjie
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 11
• Pages of publication: 2282
• a: 19.1147 ± 0.0004 Å
• b: 19.1147 ± 0.0004 Å
• c: 21.1495 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7727.4 ± 0.3 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 2 K
• Number of distinct elements: 6
• Space group number: 132
• Hermann-Mauguin space group symbol: P 42/m c m
• Hall space group symbol: -P 4c 2c
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.0629
• Weighted residual factors for significantly intense reflections: 0.2064
• Weighted residual factors for all reflections included in the refinement: 0.2178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.168
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No