Information card for entry 2008935

Structure parameters

• Common name: [Ni(3,5-Cl4salMetrien)]
• Chemical name: (1,4-dioxan-O) [3,3'-methyliminobis(1,3-propanediylnitrilomethylidyne)di-3'',5''-dichloroph enolate-N,N',N'',O] nickel(II)
• Formula: C25 H29 Cl4 N3 Ni O4
• Calculated formula: C25 H26 Cl4 N3 Ni O4
• Title of publication: (1,4-Dioxane-<i>O</i>){3,3',5,5'-tetrachloro-2,2'-[4-methyl-4-azaheptane-1,7-diylbis(nitrilomethylidyne-<i>N</i>)]diphenolato-<i>O</i>,<i>O</i>'}nickel(II), [Ni(3,5-Cl~4~salMetrien)]
• Authors of publication: Gomes, Ligia; Pinho, Dora; Freire, Cristina; de Castro, Baltazar
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 1425 - 1427
• a: 28.308 ± 0.003 Å
• b: 11.306 ± 0.003 Å
• c: 20.622 ± 0.003 Å
• α: 90°
• β: 123.5 ± 0.02°
• γ: 90°
• Cell volume: 5504 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.076
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for all reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.091
• Goodness-of-fit parameter for all reflections: 1.31
• Goodness-of-fit parameter for all reflections included in the refinement: 1.346
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No