Information card for entry 4506153

Structure parameters

• Formula: C12 H12 Cl4 Cu N2
• Calculated formula: C12 H12 Cl4 Cu N2
• SMILES: c1c([n]([Cu](Cl)([n]2ccccc2CCl)Cl)ccc1)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: 15.313 ± 0.003 Å
• b: 7.7984 ± 0.0016 Å
• c: 14.329 ± 0.003 Å
• α: 90°
• β: 117.31 ± 0.03°
• γ: 90°
• Cell volume: 1520.4 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0467
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0722
• Weighted residual factors for all reflections included in the refinement: 0.1047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No