Information card for entry 4000437

Structure parameters

• Common name: (10) Zn(DMP)2(py)2
• Formula: C26 H28 N2 O2 Zn
• Calculated formula: C26 H28 N2 O2 Zn
• SMILES: Cc1cccc(c1O[Zn]([n]1ccccc1)([n]1ccccc1)Oc1c(C)cccc1C)C
• Journal of publication: Chemistry of Materials
• Year of publication: 2004
• a: 14.232 ± 0.003 Å
• b: 12.391 ± 0.003 Å
• c: 14.194 ± 0.003 Å
• α: 90°
• β: 108.743 ± 0.004°
• γ: 90°
• Cell volume: 2370.5 ± 1 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0353
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.0693
• Weighted residual factors for all reflections included in the refinement: 0.0715
• 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