Information card for entry 2219007

Structure parameters

• Chemical name: Bis{μ-4-chloro-2-[(2-pyridylethyl)iminomethyl]phenolato}bis[chloridocopper(II)]
• Formula: C28 H24 Cl4 Cu2 N4 O2
• Calculated formula: C28 H24 Cl4 Cu2 N4 O2
• SMILES: C1Cc2cccc[n]2[Cu]23([N]1=Cc1c([O]2[Cu]24([n]5c(CC[N]2=Cc2c([O]34)ccc(c2)Cl)cccc5)Cl)ccc(c1)Cl)Cl
• Title of publication: Bis{μ-4-chloro-2-[(2-pyridylethyl)iminomethyl]phenolato}bis[chloridocopper(II)]
• Authors of publication: Suo, Jianlan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 8
• Pages of publication: m1046
• a: 9.9703 ± 0.001 Å
• b: 9.0119 ± 0.0011 Å
• c: 16.5018 ± 0.0016 Å
• α: 90°
• β: 96.039 ± 0.001°
• γ: 90°
• Cell volume: 1474.5 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0435
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0731
• Weighted residual factors for all reflections included in the refinement: 0.0815
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes