Information card for entry 2214081

Structure parameters

• Chemical name: catena-Poly[[{2,4-dichloro-6-[2- (ethylamino)ethyliminomethyl]phenolato}copper(II)]-μ-azido]
• Formula: C11 H13 Cl2 Cu N5 O
• Calculated formula: C11 H13 Cl2 Cu N5 O
• SMILES: [Cu]12(Oc3c(Cl)cc(Cl)cc3C=[N]1CC[NH]2CC)(N=N#N)[N]([Cu]12Oc3c(Cl)cc(Cl)cc3C=[N]1CC[NH]2CC)=N#N
• Title of publication: <i>catena</i>-Poly[[{2,4-dichloro-6-[2-(ethylamino)ethyliminomethyl]phenolato}copper(II)]-μ-azido]
• Authors of publication: Yun-Peng Diao; Xiao-Hong Shu; Bao-Jing Zhang; Yu-Hong Zhen; Ting-Guo Kang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 7
• Pages of publication: m1816 - m1816
• a: 9.0767 ± 0.0018 Å
• b: 22.897 ± 0.004 Å
• c: 7.2953 ± 0.0014 Å
• α: 90°
• β: 96.448 ± 0.003°
• γ: 90°
• Cell volume: 1506.6 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0547
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.0893
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes