Information card for entry 7027555

Structure parameters

• Formula: C12 H12 Cu N8
• Calculated formula: C12 H12 Cu N8
• SMILES: [Cu]1([n]2c(c3[n]1ccc(c3)C)cc(cc2)C)(N=N#N)N=N#N
• Title of publication: Crystal structures and magnetic properties of two alternating azide-bridged complexes [{M(dmbpy)(N3)2}n] (M = Mn or Cu; dmbpy = 4,4′-dimethyl-2,2′-bipyridine) †
• Authors of publication: Shen, Zhen; Zuo, Jing-Lin; Yu, Zhi; Zhang, Yong; Bai, Jun-Feng; Che, Chi-Ming; Fun, Hoong-Kun; Vittal, Jagadese J.; You, Xiao-Zeng
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 19
• Pages of publication: 3393
• a: 7.961 ± 0.0006 Å
• b: 9.392 ± 0.0006 Å
• c: 10.7626 ± 0.0008 Å
• α: 113.439 ± 0.001°
• β: 101.228 ± 0.001°
• γ: 101.982 ± 0.001°
• Cell volume: 686.89 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0582
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1151
• Weighted residual factors for all reflections included in the refinement: 0.1223
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No