Information card for entry 4346799

Structure parameters

• Formula: C47.8 H39.3 Cu2 I2 N8 O1.7
• Calculated formula: C47.8 H39.3 Cu2 I2 N8 O1.7
• Title of publication: Copper(I) Metal-Organic Framework: Visual Sensor for Detecting Small Polar Aliphatic Volatile Organic Compounds.
• Authors of publication: Yu, Yang; Ma, Jian-Ping; Zhao, Chao-Wei; Yang, Jing; Zhang, Xiao-Meng; Liu, Qi-Kui; Dong, Yu-Bin
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 24
• Pages of publication: 11590 - 11592
• a: 26.472 ± 0.004 Å
• b: 10.4161 ± 0.0017 Å
• c: 18.492 ± 0.003 Å
• α: 90°
• β: 111.936 ± 0.002°
• γ: 90°
• Cell volume: 4729.7 ± 1.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1066
• Residual factor for significantly intense reflections: 0.0703
• Weighted residual factors for significantly intense reflections: 0.1568
• Weighted residual factors for all reflections included in the refinement: 0.1748
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No