Information card for entry 7208237

Structure parameters

• Formula: C21 H32 Cl2 Cu2 N14 O9
• Calculated formula: C21 H32 Cl2 Cu2 N14 O9
• Title of publication: σ-Aromaticity in dinuclear copper(ii) complexes: Novel interaction between perchlorate anion and σ-aromatic [Cu2X2] (X = N or O) core
• Authors of publication: Banerjee, Ishita; Dolai, Malay; Jana, Atish Dipankar; Das, Kalyan K.; Ali, Mahammad
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 15
• Pages of publication: 4972
• a: 10.5249 ± 0.0011 Å
• b: 11.8458 ± 0.0013 Å
• c: 14.1564 ± 0.0015 Å
• α: 92.248 ± 0.004°
• β: 96.654 ± 0.003°
• γ: 94.316 ± 0.003°
• Cell volume: 1746.1 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0755
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0976
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No