Information card for entry 8104620

Structure parameters

• Formula: C26 H26 N6 Ni O9
• Calculated formula: C26 H26 N6 Ni O9
• Title of publication: Crystal structure of the nickel(II) complex aqua-(2,6-di(pyrazin-2-yl)-4,4′-bipyridine-κ3 N,N′,N′′)-(phthalato-κ2 O,O′)nickel(II) tetrahydrate, C26H26N6O9Ni
• Authors of publication: Yu-Fang, Wang; Zhang, Shu-Qi
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 5
• Pages of publication: 907 - 909
• a: 11.2329 ± 0.0005 Å
• b: 11.7535 ± 0.0005 Å
• c: 12.1109 ± 0.0007 Å
• α: 70.936 ± 0.005°
• β: 75.684 ± 0.004°
• γ: 63.266 ± 0.004°
• Cell volume: 1340.14 ± 0.13 ų
• Cell temperature: 290 K
• Ambient diffraction temperature: 290 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: 0.0363
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0721
• Weighted residual factors for all reflections included in the refinement: 0.0743
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No