Information card for entry 2217748

Structure parameters

• Chemical name: Bis[2-(3-cyanophenyliminomethyl)phenolato]nickel(II)
• Formula: C28 H18 N4 Ni O2
• Calculated formula: C28 H18 N4 Ni O2
• SMILES: c12c(cccc2)O[Ni]2([N](=C1)c1cc(ccc1)C#N)[N](=Cc1c(cccc1)O2)c1cc(ccc1)C#N
• Title of publication: Bis[2-(3-cyanophenyliminomethyl)phenolato]nickel(II)
• Authors of publication: Gong, Xing-Xuan; Xia, Rong; Xu, Hai-Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 3
• Pages of publication: m494
• a: 9.0294 ± 0.0018 Å
• b: 8.0856 ± 0.0016 Å
• c: 15.644 ± 0.003 Å
• α: 90°
• β: 104.01 ± 0.03°
• γ: 90°
• Cell volume: 1108.2 ± 0.4 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0395
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0899
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes