Information card for entry 4506154

Structure parameters

• Formula: C26 H32 Cl7 Cu4 N19 O2
• Calculated formula: C26 H32 Cl7 Cu4 N19 O2
• SMILES: c1cccc([n]1[Cu]1([N]([Cu]2([N]1=N#N)([N](=N#N)[Cu]1([N](=N#N)[Cu]([N]1=N#N)([OH]C)(Cl)[n]1ccccc1CCl)([Cl]2)[n]1ccccc1CCl)[n]1ccccc1CCl)=N#N)([OH]C)Cl)CCl
• Title of publication: Ligand-Directed Assembly of Azide-Bridged Tetranuclear, One-Dimensional and Two-Dimensional Cu(II) Complexes: Synthesis, Crystal Structure and Magnetic Properties
• Authors of publication: Shi, Wen-Bo; Cui, Ai-Li; Kou, Hui-Zhong
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 7
• Pages of publication: 3436
• a: 19.966 ± 0.004 Å
• b: 9.322 ± 0.0019 Å
• c: 23.931 ± 0.005 Å
• α: 90°
• β: 91.34 ± 0.03°
• γ: 90°
• Cell volume: 4452.9 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0442
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0928
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No