Information card for entry 2215862

Structure parameters

• Chemical name: Bis{2-methoxy-6-[3-(methylamino)propyliminomethyl]phenolato}nickel(II)
• Formula: C24 H34 N4 Ni O4
• Calculated formula: C24 H34 N4 Ni O4
• SMILES: c12c(c(ccc1)OC)O[Ni]134([N](=C2)CCC[NH]1C)[N](=Cc1c(c(ccc1)OC)O4)CCC[NH]3C
• Title of publication: Bis{2-methoxy-6-[3-(methylamino)propyliminomethyl]phenolato}nickel(II)
• Authors of publication: Chun-Bao Tang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2654 - m2654
• a: 8.762 ± 0.003 Å
• b: 15.297 ± 0.005 Å
• c: 17.247 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2311.7 ± 1.3 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: 0.0709
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0766
• Weighted residual factors for all reflections included in the refinement: 0.0946
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes