Information card for entry 7232657

Structure parameters

• Formula: C29 H37 N9 O11 Zn2
• Calculated formula: C18 H8 N5 O8 Zn2
• Title of publication: A Zn(ii) metal‒organic framework constructed by a mixed-ligand strategy for CO2 capture and gas separation
• Authors of publication: Zou, Lifei; Yuan, Jiaqi; Yuan, Yang; Gu, Jiaming; Li, Guanghua; Zhang, Lirong; Liu, Yunling
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 21
• Pages of publication: 3289
• a: 20.076 ± 0.005 Å
• b: 19.744 ± 0.004 Å
• c: 14.25 ± 0.003 Å
• α: 90°
• β: 133.285 ± 0.006°
• γ: 90°
• Cell volume: 4111.8 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0454
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0846
• Weighted residual factors for all reflections included in the refinement: 0.0917
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No