Information card for entry 7027341

Structure parameters

• Formula: C18 H56 Cl4 N12 Ni2 O18
• Calculated formula: C18 H56 Cl4 N12 Ni2 O18
• Title of publication: Nickel complexes with tris(2-aminoethyl)amine (tren): [Ni3(tren)4(H2O)2][Cr(ox)3]2·6H2O (ox = oxalate), {[Ni2(tren)3][ClO4]4·H2O}n, and [Ni2(tren)2(aepd)][ClO4]4·2H2O (aepd = N-(2-aminoethyl)pyrrolidine-3,4-diamine). Synthesis, structure and magnetism †
• Authors of publication: Masters, Vanessa M.; Bernhardt, Paul V.; Gahan, Lawrence R.; Moubaraki, Boujemaa; Murray, Keith S.; Berry, Kevin J.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 14
• Pages of publication: 2323
• a: 9.968 ± 0.002 Å
• b: 15.48 ± 0.001 Å
• c: 15.684 ± 0.002 Å
• α: 118.552 ± 0.007°
• β: 104.25 ± 0.01°
• γ: 97.47 ± 0.01°
• Cell volume: 1971.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0838
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for all reflections: 0.1503
• Weighted residual factors for significantly intense reflections: 0.1283
• Goodness-of-fit parameter for all reflections: 1.02
• Goodness-of-fit parameter for significantly intense reflections: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No