Information card for entry 7214166

Structure parameters

• Formula: C50 H66 Cd2 N4 O19
• Calculated formula: C39 H35 Cd2 N O15
• Title of publication: Five MOFs with different topologies based on anthracene functionalized tetracarboxylic acid: syntheses, structures, and properties
• Authors of publication: Liu, Fuling; Zhang, Liangliang; Wang, Rongming; Sun, Jie; Yang, Jie; Chen, Zhen; Wang, Xingpo; Sun, Daofeng
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 14
• Pages of publication: 2917
• a: 15.4676 ± 0.0017 Å
• b: 13.1962 ± 0.0015 Å
• c: 26.497 ± 0.003 Å
• α: 90°
• β: 98.729 ± 0.002°
• γ: 90°
• Cell volume: 5345.8 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0551
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1128
• Weighted residual factors for all reflections included in the refinement: 0.1197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No