Information card for entry 7013521

Structure parameters

• Common name: 16
• Formula: C30 H30 N4 O8 Zn2
• Calculated formula: C30 H30 N4 O8 Zn2
• SMILES: [Zn]1([n]2c(C(C3c4cccc[n]4[Zn]([n]4c3cccc4)(OC(=O)C)OC(=O)C)c3[n]1cccc3)cccc2)(OC(=O)C)OC(=O)C
• Title of publication: Coordination chemistry of di-2-pyridylmethane and related bridging ligands with silver(i), copper(ii), palladium(ii) and zinc(ii)
• Authors of publication: Steel, Peter J.; Sumby, Christopher J.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 23
• Pages of publication: 4505
• a: 9.898 ± 0.003 Å
• b: 7.975 ± 0.003 Å
• c: 18.728 ± 0.006 Å
• α: 90°
• β: 96.104 ± 0.004°
• γ: 90°
• Cell volume: 1469.9 ± 0.9 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0421
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0674
• Weighted residual factors for all reflections included in the refinement: 0.0749
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No