Information card for entry 7249373

Structure parameters

• Formula: C18 H13 N O7 Zn
• Calculated formula: C18 H13 N O7 Zn
• Title of publication: Design and synthesis of two functional coordination polymers based on the 1,1′-bis(3-carboxybenzyl)-4,4′-bipyridinium ligand
• Authors of publication: Chen, Jiali; Fu, Yuying; Liu, Qiaoyun; Shen, Shoujie; Liu, Jinjian
• Journal of publication: CrystEngComm
• Year of publication: 2024
• a: 10.9146 ± 0.0004 Å
• b: 10.098 ± 0.0003 Å
• c: 15.0368 ± 0.0004 Å
• α: 90°
• β: 99.246 ± 0.003°
• γ: 90°
• Cell volume: 1635.76 ± 0.09 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0899
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1009
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No