Information card for entry 4333589

Structure parameters

• Formula: C24 H21 Cl4 N5 Zn2
• Calculated formula: C24 H21 Cl4 N5 Zn2
• SMILES: [Zn]1(Cl)(Cl)[n]2c(cccc2)CN(Cc2[n]1cccc2)c1cccc([N]2[Zn](Cl)(Cl)[n]3c(cccc3)C=2)c1
• Title of publication: Syntheses and Electronic Structure of Bimetallic Complexes Containing a Flexible Redox-Active Bridging Ligand
• Authors of publication: Stacey Lindsay; Siu K. Lo; Oliver R. Maguire; Eckhard Bill; Michael R. Probert; Stephen Sproules; Corinna R. Hess
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 898 - 909
• a: 7.1827 ± 0.0002 Å
• b: 9.441 ± 0.0002 Å
• c: 20.274 ± 0.0004 Å
• α: 77.856 ± 0.001°
• β: 87.949 ± 0.001°
• γ: 72.37 ± 0.001°
• Cell volume: 1280.35 ± 0.05 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0247
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0638
• Weighted residual factors for all reflections included in the refinement: 0.0645
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54188 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No