Information card for entry 2008493

Structure parameters

• Common name: Tris(1,3-diaminopropane-N,N')nickel(II) diperchlorate
• Chemical name: Tris(1,3-diaminopropane-N,N')nickel(II) diperchlorate
• Formula: C9 H30 Cl2 N6 Ni O8
• Calculated formula: C9 H30 Cl2 N6 Ni O8
• SMILES: [Ni]123([NH2]CCC[NH2]1)([NH2]CCC[NH2]3)[NH2]CCC[NH2]2.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: Tris(1,3-diaminopropane-<i>N</i>,<i>N</i>')nickel(II) diperchlorate
• Authors of publication: Olof Kristiansson
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 5
• Pages of publication: IUC9900038
• a: 14.06 ± 0.0009 Å
• b: 26.4879 ± 0.0016 Å
• c: 32.732 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12190 ± 1.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.104
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.195
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No