Information card for entry 2010850

Structure parameters

• Formula: C28 H22 N2 Ni O2
• Calculated formula: C28 H22 N2 Ni O2
• SMILES: [Ni]123Oc4ccccc4C=[N]2[C@@H](c2ccccc2)[C@H]([N]3=Cc2ccccc2O1)c1ccccc1
• Title of publication: [<i>N</i>,<i>N</i>'-Bis(salicylidene)-1,2-diphenyl-(<i>RS</i>,<i>SR</i>)-1,2-ethanediaminato]nickel(II)
• Authors of publication: Hoshina, Gakuse; Tsuchimoto, Masanobu; Ohba, Shigeru
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 4
• Pages of publication: e122 - e122
• a: 12.517 ± 0.002 Å
• b: 11.5 ± 0.003 Å
• c: 16.413 ± 0.002 Å
• α: 90°
• β: 106.893 ± 0.009°
• γ: 90°
• Cell volume: 2260.6 ± 0.8 ų
• Cell temperature: 297 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.109
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes