Information card for entry 2218856

Structure parameters

• Chemical name: Bis{2-[3-(dimethylamino)propyliminomethyl]-6-methoxyphenolato-\ κ^3^N,N',O^1^}nickel(II)
• Formula: C26 H38 N4 Ni O4
• Calculated formula: C26 H38 N4 Ni O4
• SMILES: c12c(cccc1C=[N]1CCC[N](C)(C)[Ni]341(O2)[N](=Cc1c(c(ccc1)OC)O4)CCC[N]3(C)C)OC
• Title of publication: Bis{2-[3-(dimethylamino)propyliminomethyl]-6-methoxyphenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>^1^}nickel(II)
• Authors of publication: Guo, Hang-Ming; Lin, Hong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 8
• Pages of publication: m1009
• a: 7.4758 ± 0.0015 Å
• b: 8.5571 ± 0.0017 Å
• c: 10.995 ± 0.002 Å
• α: 78.36 ± 0.03°
• β: 73.98 ± 0.03°
• γ: 73.73 ± 0.03°
• Cell volume: 643 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0313
• Residual factor for significantly intense reflections: 0.0281
• Weighted residual factors for significantly intense reflections: 0.0749
• Weighted residual factors for all reflections included in the refinement: 0.0769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes