Information card for entry 7059709

Structure parameters

• Formula: C4 H7 N15 O2 Zn2
• Calculated formula: C4 H7 N15 O2 Zn2
• Title of publication: A three-dimensional metal‒organic framework with high performance of dual cation sensing synthesized via single-crystal transformation
• Authors of publication: Talha, Khalid; Alamgir,; He, Tao; Xie, Lin-Hua; Wang, Bin; Zhao, Min-Jian; Zhang, Yong-Zheng; Chen, Qiang; Li, Jian-Rong
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 27
• Pages of publication: 11829 - 11834
• a: 10.3743 ± 0.0005 Å
• b: 17.9247 ± 0.0007 Å
• c: 11.0539 ± 0.0006 Å
• α: 90°
• β: 114.482 ± 0.006°
• γ: 90°
• Cell volume: 1870.73 ± 0.18 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: 0.1474
• Residual factor for significantly intense reflections: 0.1444
• Weighted residual factors for significantly intense reflections: 0.375
• Weighted residual factors for all reflections included in the refinement: 0.377
• Goodness-of-fit parameter for all reflections included in the refinement: 0.947
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No