Information card for entry 7202870

Structure parameters

• Formula: C28 H24 N6 O4 Zn
• Calculated formula: C28 H24 N6 O4 Zn
• SMILES: C1(=N[N]2=C(C)c3[n]([Zn]452([N](=C(c2[n]4cccc2)C)N=C(c2c(cccc2)O)O5)O1)cccc3)c1c(cccc1)O
• Title of publication: Synthesis and structure of 2-acetylpyridine-salicyloylhydrazone and its copper(ii) and zinc(ii) complexes. The effect of the metal coordination on the weak intermolecular interactions
• Authors of publication: Barbazán, Paula; Carballo, Rosa; Vázquez-López, Ezequiel M.
• Journal of publication: CrystEngComm
• Year of publication: 2007
• Journal volume: 9
• Journal issue: 8
• Pages of publication: 668
• a: 12.598 ± 0.004 Å
• b: 18.483 ± 0.006 Å
• c: 10.818 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2519 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 41
• Hermann-Mauguin space group symbol: A b a 2
• Hall space group symbol: A 2 -2ab
• Residual factor for all reflections: 0.1166
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections included in the refinement: 0.0788
• Goodness-of-fit parameter for all reflections included in the refinement: 0.889
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No