Information card for entry 7238822

Structure parameters

• Formula: C18 H7 Cl Cu N0 O6
• Calculated formula: C18 H7 Cl Cu O6
• Title of publication: A microporous metal‒organic framework assembled from an aromatic tetracarboxylate for H2 purification
• Authors of publication: He, Yabing; Xiang, Shengchang; Zhang, Zhangjing; Xiong, Shunshun; Wu, Chuande; Zhou, Wei; Yildirim, Taner; Krishna, Rajamani; Chen, Banglin
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2013
• Journal volume: 1
• Journal issue: 7
• Pages of publication: 2543
• a: 18.5676 ± 0.0007 Å
• b: 18.5676 ± 0.0007 Å
• c: 52.205 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 15586.7 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 155
• Hermann-Mauguin space group symbol: R 3 2 :H
• Hall space group symbol: R 3 2"
• Residual factor for all reflections: 0.0962
• Residual factor for significantly intense reflections: 0.0715
• Weighted residual factors for significantly intense reflections: 0.1895
• Weighted residual factors for all reflections included in the refinement: 0.2237
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No