Information card for entry 4000426

Structure parameters

• Common name: (1) Zn2(ONep)2(Et)2(py)2
• Formula: C24 H42 N2 O2 Zn2
• Calculated formula: C24 H42 N2 O2 Zn2
• SMILES: CC[Zn]1([n]2ccccc2)[O]([Zn]([O]1CC(C)(C)C)(CC)[n]1ccccc1)CC(C)(C)C
• Journal of publication: Chemistry of Materials
• Year of publication: 2004
• a: 10.0364 ± 0.0006 Å
• b: 19.0397 ± 0.0011 Å
• c: 14.6644 ± 0.0009 Å
• α: 90°
• β: 98.192 ± 0.001°
• γ: 90°
• Cell volume: 2773.6 ± 0.3 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 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: 0.0463
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.0954
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No