Information card for entry 2223679

Structure parameters

• Chemical name: Bis(2-iminomethyl-5-methoxyphenolato)nickel(II)
• Formula: C16 H16 N2 Ni O4
• Calculated formula: C16 H16 N2 Ni O4
• SMILES: [Ni]12(Oc3c(ccc(c3)OC)C=[NH]1)[NH]=Cc1c(cc(cc1)OC)O2
• Title of publication: Bis(2-iminomethyl-5-methoxyphenolato)nickel(II)
• Authors of publication: Tang, Chunbao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: m1275
• a: 7.5704 ± 0.0016 Å
• b: 11.331 ± 0.002 Å
• c: 17.227 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1477.7 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0464
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0733
• Weighted residual factors for all reflections included in the refinement: 0.0834
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes