Information card for entry 2215992

Structure parameters

• Chemical name: Dibromido-2κ^2^Br-bis(4-methylpyridine-1κN){μ-2,2'-[propane-1,3- diylbis(nitrilomethylidyne)]diphenolato- 1κ^4^O,N,N',O':2κ^2^O,O'}nickel(II)zinc(II)
• Formula: C29 H30 Br2 N4 Ni O2 Zn
• Calculated formula: C29 H30 Br2 N4 Ni O2 Zn
• SMILES: Br[Zn]1(Br)[O]2[Ni]34([O]1c1c(C=[N]4CCC[N]3=Cc3c2cccc3)cccc1)([n]1ccc(cc1)C)[n]1ccc(cc1)C
• Title of publication: Dibromido-2κ^2^<i>Br</i>-bis(4-methylpyridine-1κ<i>N</i>){μ-2,2'-[propane-1,3-diylbis(nitrilomethylidyne)]diphenolato-1κ^4^<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>':2κ^2^<i>O</i>,<i>O</i>'}nickel(II)zinc(II)
• Authors of publication: Tatar Yıldırım, Leyla; Atakol, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2676 - m2677
• a: 19.357 ± 0.003 Å
• b: 9.213 ± 0.0007 Å
• c: 18.3269 ± 0.0015 Å
• α: 90°
• β: 114.382 ± 0.01°
• γ: 90°
• Cell volume: 2976.9 ± 0.6 ų
• Cell temperature: 294 ± 2 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.1395
• Residual factor for significantly intense reflections: 0.0656
• Weighted residual factors for significantly intense reflections: 0.1723
• Weighted residual factors for all reflections included in the refinement: 0.2062
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes