Information card for entry 7708531

Structure parameters

• Formula: C19 H21 Cu N5 O7
• Calculated formula: C19 H21 Cu N5 O7
• Title of publication: Dual-emission 3D supramolecular framework hydrogel beads: highly selective detection of antibiotics and mechanism research
• Authors of publication: Zhu, Ke; Fan, Ruiqing; Zhang, Jian; Jiang, Xin; Jia, Wenwen; Wang, Bowen; Lu, Haoyang; Wu, Jingkun; Wang, Ping; Yang, Yulin
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 10.1215 ± 0.0005 Å
• b: 20.6659 ± 0.0011 Å
• c: 10.3207 ± 0.0007 Å
• α: 90°
• β: 93.249 ± 0.002°
• γ: 90°
• Cell volume: 2155.3 ± 0.2 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0702
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.1067
• Weighted residual factors for all reflections included in the refinement: 0.1212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No