Information card for entry 7008179

Structure parameters

• Common name: (tris(2-aminoethyl)amine)-nickel(ii)(N,N'-bis(2- Hydroxyiminopropionyl) ethane-1,2-diamine)-nickel(ii) dihydrate
• Chemical name: (tris(2-aminoethyl)amine)-nickel(II)(N,N'-bis(2-Hydroxyiminopropionyl) ethane-1,2-diamine)-nickel(II) dihydrate
• Formula: C14 H32 N8 Ni2 O6
• Calculated formula: C14 H32 N8 Ni2 O6
• SMILES: [Ni]123[N]4O[Ni]567(O[N]3=C(C(=O)N2CCN1C(=O)C=4C)C)[N](CC[NH2]5)(CC[NH2]6)CC[NH2]7.O.O
• Title of publication: Effect of metal ionic radius and chelate ring alternation motif on stabilization of trivalent nickel and copper in binuclear complexes with double cis-oximato bridges.
• Authors of publication: Kanderal, Olga M.; Kozlowski, Henryk; Dobosz, Agnieszka; Swiatek-Kozlowska, Jolanta; Meyer, Franc; Fritsky, Igor O.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 8
• Pages of publication: 1428 - 1437
• a: 7.743 ± 0.002 Å
• b: 14.627 ± 0.003 Å
• c: 19.177 ± 0.004 Å
• α: 90 ± 0.03°
• β: 96.77 ± 0.03°
• γ: 90 ± 0.03°
• Cell volume: 2156.8 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0513
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1262
• Weighted residual factors for all reflections included in the refinement: 0.1314
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No