Information card for entry 7019616

Structure parameters

• Common name: [(NONO)3Zn10]
• Formula: C48 H84 N6 O10 Zn10
• Calculated formula: C48 H84 N6 O10 Zn10
• SMILES: C1(C)=CC(C)=[N]2CC[N]3=C(C)C=C(C)[O]4[Zn]523[O]1[Zn]4(CC)[O]1([Zn]23[O]45[Zn]5(CC)[O]6C(C)=CC(C)=[N]7CC[N]8=C(C)C=C(C)[O]5[Zn]678[O]52[Zn]2(CC)[O]6C(C)=CC(C)=[N]7CC[N]8=C(C)C=C(C)[O]2[Zn]1678)[Zn](CC)[O]3([Zn]4CC)[Zn]5CC
• Title of publication: A 1D Schiff base zinc polymer as a versatile metallo-ligand for the synthesis of polynuclear zinc cages.
• Authors of publication: Richards, Anne F.; Aprile, Antonino; Hogan, Conor F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 27
• Pages of publication: 8361 - 8367
• a: 21.0729 ± 0.0012 Å
• b: 21.0729 ± 0.0012 Å
• c: 24.0603 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 9253 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0517
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0683
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No