Information card for entry 2011369

Structure parameters

• Chemical name: Tetrakis(imidazole-N^3^)nickel(II) diacetate
• Formula: C16 H22 N8 Ni O4
• Calculated formula: C16 H22 N8 Ni O4
• SMILES: c1[n]([Ni]([n]2c[nH]cc2)([n]2c[nH]cc2)[n]2c[nH]cc2)cc[nH]1.C(=O)(C)[O-].C(=O)(C)[O-]
• Title of publication: Bis(acetato-<i>O</i>)tetrakis(imidazole-<i>N</i>^3^)nickel(II)
• Authors of publication: Naumov, Pance; Ristova, Mirjana; Drew, Michael G. B.; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 9
• Pages of publication: e372 - e373
• a: 13.46 ± 0.02 Å
• b: 8.62 ± 0.01 Å
• c: 17.89 ± 0.02 Å
• α: 90°
• β: 105.28 ± 0.01°
• γ: 90°
• Cell volume: 2002 ± 4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.047
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for all reflections included in the refinement: 0.105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No