Information card for entry 7229825

Structure parameters

• Formula: C28 H44 Cu4 I4 N4 O32 Y4
• Calculated formula: C28 H44 Cu4 I4 N4 O32 Y4
• Title of publication: Incorporating Cuprous-halide Clusters and Lanthanide Clusters to Construct Heterometallic Cluster Organic Frameworks with Luminescent and Gas Adsorption Properties
• Authors of publication: Liu, Jin-Hua; Gu, Ya-Nan; Chen, Yi; Qi, Yan-Jie; Li, Xin-Xiong; Zheng, Shou-Tian
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 18.529 ± 0.004 Å
• b: 18.529 ± 0.004 Å
• c: 12.303 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4223.9 ± 1.5 ų
• Cell temperature: 175 ± 2 K
• Ambient diffraction temperature: 175 ± 2 K
• Number of distinct elements: 7
• Space group number: 129
• Hermann-Mauguin space group symbol: P 4/n m m
• Hall space group symbol: -P 4a 2a
• Residual factor for all reflections: 0.0631
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1746
• Weighted residual factors for all reflections included in the refinement: 0.1808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No