Information card for entry 2231465

Structure parameters

• Chemical name: <i>trans</i>-Diaquabis(DL-valinato-κ^2^<i>N</i>,<i>O</i>)nickel(II)
• Formula: C10 H22 N2 Ni O6
• Calculated formula: C10 H22 N2 Ni O6
• SMILES: C1(=O)C(C(C)C)=[NH][Ni]2(O1)([OH2])([NH]=C(C(=O)O2)C(C)C)[OH2]
• Title of publication: <i>trans</i>-Diaquabis(<small>DL</small>-valinato-κ^2^<i>N</i>,<i>O</i>)nickel(II)
• Authors of publication: Messai, Amel; Benali-Cherif, Rim; Jeanneau, Erwann; Benali-Cherif, Nourredine
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: m1204
• a: 24.8881 ± 0.0002 Å
• b: 5.8701 ± 0.0003 Å
• c: 10.0789 ± 0.0002 Å
• α: 90°
• β: 90.442 ± 0.003°
• γ: 90°
• Cell volume: 1472.44 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0662
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1449
• Weighted residual factors for all reflections included in the refinement: 0.1507
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes