Information card for entry 7218450

Structure parameters

• Formula: C54 H46 Cd3 N8 O18
• Calculated formula: C54 H46 Cd3 N8 O18
• Title of publication: The various architectures and properties of a series of coordination polymers tuned by the central metals and auxiliary N-donor ligands
• Authors of publication: Wu, He; Sun, Wujuan; Shi, Ting; Liao, Xuzhao; Zhao, Wenjie; Yang, Xuwu
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 48
• Pages of publication: 11088
• a: 10.0418 ± 0.0012 Å
• b: 9.7038 ± 0.0012 Å
• c: 26.051 ± 0.003 Å
• α: 90°
• β: 95.109 ± 0.002°
• γ: 90°
• Cell volume: 2528.4 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0893
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.1284
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No