Information card for entry 2227984

Structure parameters

• Chemical name: <i>trans</i>-Bis(ethylenediamine)bis{2-[<i>N</i>-(2- hydroxyethyl)oxamoylamino]benzoato}nickel(II)
• Formula: C26 H38 N8 Ni O10
• Calculated formula: C26 H38 N8 Ni O10
• SMILES: C(=O)(c1ccccc1NC(=O)C(=O)NCCO)O[Ni]12([NH2]CC[NH2]1)([NH2]CC[NH2]2)OC(=O)c1ccccc1NC(=O)C(=O)NCCO
• Title of publication: <i>trans</i>-Bis(ethylenediamine)bis{2-[<i>N</i>-(2-hydroxyethyl)oxamoylamino]benzoato}nickel(II)
• Authors of publication: Yu, Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 9
• Pages of publication: m1140
• a: 8.266 ± 0.002 Å
• b: 10.122 ± 0.003 Å
• c: 10.26 ± 0.003 Å
• α: 109.589 ± 0.003°
• β: 95.72 ± 0.003°
• γ: 103.788 ± 0.003°
• Cell volume: 770.2 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0411
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0784
• Weighted residual factors for all reflections included in the refinement: 0.084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes