Information card for entry 7249372

Structure parameters

• Formula: C21 H14 N O6 Zn
• Calculated formula: C21 H14 N O6 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: 20.1367 ± 0.0018 Å
• b: 11.0593 ± 0.0011 Å
• c: 21.1107 ± 0.0018 Å
• α: 90°
• β: 127.242 ± 0.002°
• γ: 90°
• Cell volume: 3742.6 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1225
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1096
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No