Information card for entry 2202248

Structure parameters

• Chemical name: catena-poly[[bis[cis-1-(2,4,6-trimethylphenyl)tetrazole-κN^4^]copper(II)]- di-μ-chloro]
• Formula: C20 H24 Cl2 Cu N8
• Calculated formula: C20 H24 Cl2 Cu N8
• SMILES: [Cu]([n]1cn(c2c(cc(cc2C)C)C)nn1)([n]1cn(c2c(cc(cc2C)C)C)nn1)(Cl)Cl
• Title of publication: Chain structure of <i>catena</i>-poly[[bis[<i>cis</i>-1-(2,4,6-trimethylphenyl)tetrazole-κ<i>N</i>^4^]copper(II)]-di-μ-chloro]
• Authors of publication: Ivashkevich, Dmitry O.; Lyakhov, Alexander S.; Degtyarik, Mikhail M.; Gaponik, Pavel N.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 1
• Pages of publication: m14 - m16
• a: 7.283 ± 0.002 Å
• b: 12.032 ± 0.003 Å
• c: 13.912 ± 0.003 Å
• α: 85.97 ± 0.02°
• β: 84.19 ± 0.02°
• γ: 75.82 ± 0.02°
• Cell volume: 1174.6 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.048
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes