Information card for entry 7123387

Structure parameters

• Formula: C12 H11 N O4 Zn
• Calculated formula: C12 H11 N O4 Zn
• Title of publication: A robust etb-type metal-organic framework showing polarity-exclusive adsorption of acetone over methanol for their azeotropic mixture.
• Authors of publication: Hu, Han; Zhu, Jiaxing; Yang, Feilong; Chen, Zhenxia; Deng, Mingli; Weng, Linhong; Ling, Yun; Zhou, Yaming
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2019
• a: 28.868 ± 0.007 Å
• b: 28.868 ± 0.007 Å
• c: 8.261 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5962 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 166
• Hermann-Mauguin space group symbol: R -3 m :H
• Hall space group symbol: -R 3 2"
• Residual factor for all reflections: 0.0406
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.1092
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.175
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No