Information card for entry 2229752

Structure parameters

• Chemical name: Bis{1-[(4-methylphenyl)iminomethyl]-2-naphtholato- κ^2^<i>N</i>,<i>O</i>}nickel(II)
• Formula: C36 H28 N2 Ni O2
• Calculated formula: C36 H28 N2 Ni O2
• SMILES: [Ni]12([N](c3ccc(cc3)C)=Cc3c4ccccc4ccc3O2)[N](=Cc2c3ccccc3ccc2O1)c1ccc(cc1)C
• Title of publication: Bis{1-[(4-methylphenyl)iminomethyl]-2-naphtholato-κ^2^<i>N</i>,<i>O</i>}nickel(II)
• Authors of publication: Wang, Quanbo; Jiang, Jianzhuang; Zhu, Peihua
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 4
• Pages of publication: m470
• a: 7.1159 ± 0.0004 Å
• b: 9.995 ± 0.0005 Å
• c: 10.5803 ± 0.0005 Å
• α: 103.057 ± 0.004°
• β: 96.327 ± 0.004°
• γ: 103.488 ± 0.004°
• Cell volume: 702.21 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0344
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0722
• Weighted residual factors for all reflections included in the refinement: 0.0736
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes