Information card for entry 1564754

Structure parameters

• Formula: C18 H17 N2 Ni O5
• Calculated formula: C18 H17 N2 Ni O5
• Title of publication: Synthesis, crystal structures and properties of five novel coordination polymers and application in removing heavy metals from water
• Authors of publication: Li, Kan; Li, Jing-jing; Zhao, Ni; Di, Bin; Ma, Ying; Xu, Li-li
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 507
• Pages of publication: 119598
• a: 7.3286 ± 0.0002 Å
• b: 9.3775 ± 0.0003 Å
• c: 13.3478 ± 0.0004 Å
• α: 103.527 ± 0.003°
• β: 102.627 ± 0.002°
• γ: 100.436 ± 0.003°
• Cell volume: 843.81 ± 0.05 ų
• Cell temperature: 298.46 ± 0.1 K
• Ambient diffraction temperature: 298.46 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0335
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0732
• Weighted residual factors for all reflections included in the refinement: 0.075
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No