Information card for entry 2215044

Structure parameters

• Chemical name: Aqua(N,N-diethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')(pyridine-2,6-\ dicarboxylato-κ^3^N,O,O')nickel(II) 2.5-hydrate
• Formula: C13 H26 N3 Ni O7.5
• Calculated formula: C13 H22 N3 Ni O7.5
• Title of publication: Aqua(<i>N</i>,<i>N</i>-diethylethylenediamine-κ^2^<i>N</i>,<i>N</i>')(pyridine-2,6-dicarboxylato-κ^3^<i>N</i>,<i>O</i>,<i>O</i>')nickel(II) 2.5-hydrate
• Authors of publication: Ibrahim Uçar; Ahmet Bulut; Canan Kazak
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: m2327 - m2328
• a: 11.268 ± 0.004 Å
• b: 14.141 ± 0.005 Å
• c: 22.831 ± 0.012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3638 ± 3 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 72
• Hermann-Mauguin space group symbol: I m c b
• Hall space group symbol: -I 2a 2
• Residual factor for all reflections: 0.0493
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1206
• Weighted residual factors for all reflections included in the refinement: 0.1229
• Goodness-of-fit parameter for all reflections included in the refinement: 1.175
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes