Information card for entry 2214839

Structure parameters

• Chemical name: cis-Bis(tricyanomethanido-κN)[tris(2-aminoethyl)amine-κ^4^N]nickel(II))
• Formula: C14 H18 N10 Ni
• Calculated formula: C14 H18 N10 Ni
• SMILES: N#CC(=C=N[Ni]123([NH2]CC[N]3(CC[NH2]1)CC[NH2]2)N=C=C(C#N)C#N)C#N
• Title of publication: <i>cis</i>-Bis(tricyanomethanido-κ<i>N</i>)[tris(2-aminoethyl)amine-κ^4^<i>N</i>]nickel(II)
• Authors of publication: Potočňák, Ivan; Lancz, Gábor; Růžička, Aleš; Jäger, Lothar
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: m2072 - m2073
• a: 14.4376 ± 0.0011 Å
• b: 15.2861 ± 0.0012 Å
• c: 8.0888 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1785.2 ± 0.2 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 4
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0692
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.0789
• Weighted residual factors for all reflections included in the refinement: 0.0906
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes