Information card for entry 7220530

Structure parameters

• Formula: C32 H42 Cd N10 O7
• Calculated formula: C20 H15 Cd N7 O4
• Title of publication: A pillar-layer MOF for detection of small molecule acetone and metal ions in dilute solution
• Authors of publication: Su, Zhong-Min; Wang, Hai-Ning; Jiang, Si-Quan; Lu, Qing-Yun; Zhou, Ziyan; Zhuo, Shuping; Shan, Guogang
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 15.136 ± 0.005 Å
• b: 17.265 ± 0.005 Å
• c: 14.239 ± 0.005 Å
• α: 90°
• β: 95.717 ± 0.005°
• γ: 90°
• Cell volume: 3702 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0483
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.077
• Goodness-of-fit parameter for all reflections included in the refinement: 0.911
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No