Information card for entry 2208481

Structure parameters

• Chemical name: Bis(2-aminoacetato-κ^2^N,O)aquanickel(II)
• Formula: C4 H10 N2 Ni O5
• Calculated formula: C4 H10 N2 Ni O5
• SMILES: [Ni]12(OC(=O)C[NH2]1)(OC(=O)C[NH2]2)[OH2]
• Title of publication: Bis(2-aminoacetato-κ^2^<i>N</i>,<i>O</i>)aquanickel(II)
• Authors of publication: Ding, Yang-Jun; Sun, Yu-Xi; Zhang, Nian-Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: m728 - m730
• a: 5.2174 ± 0.0015 Å
• b: 10.823 ± 0.003 Å
• c: 13.517 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 763.3 ± 0.4 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.076
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.0722
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes