Information card for entry 1565495

Structure parameters

• Formula: C86 H68 N12 Ni3 O20
• Calculated formula: C86 H68 N12 Ni3 O20
• Title of publication: Five coordination polymers based on two asymmetric Semi-rigid carboxylate organic ligands and N-donor 4, 4′-di (1H-imidazol-1-yl)-1, 1′-biphenyl ligand: Solvent-induced synthesis, crystal structures, magnetic and dye absorption properties
• Authors of publication: Hu, Dong-Cheng; Wu, Ya-Jun; Sun, Jing; Shang, Ke-Xia; Yao, Xiao-Qiang; Yang, Yun-Xia; Liu, Jia-Cheng
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 502
• Pages of publication: 119356
• a: 36.686 ± 0.003 Å
• b: 10.0855 ± 0.0008 Å
• c: 23.456 ± 0.0018 Å
• α: 90°
• β: 118.396 ± 0.0017°
• γ: 90°
• Cell volume: 7634.4 ± 1.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0533
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No