Information card for entry 1561881

Structure parameters

• Formula: C22 H22 Cu4 I4 N6 O4
• Calculated formula: C22 H22 Cu4 I4 N6 O4
• SMILES: c12nc(ccc2)C2OCC[N]=2[Cu]2345[Cu]678([I][Cu]947([I]6)[Cu]58([I]2)([I]3)[N]2=C(c3cccc(n3)C3OCC[N]9=3)OCC2)[N]2=C1OCC2
• Title of publication: Syntheses, characterization and properties of silver, copper and palladium complexes from bis(oxazoline)-containing ligands
• Authors of publication: Kuai, Hai-Wei; Cheng, Xiao-Chun; Li, Deng-Hao; Hu, Tao; Zhu, Xiao-Hong
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2015
• Journal volume: 228
• Pages of publication: 65 - 75
• a: 17.642 ± 0.005 Å
• b: 21.495 ± 0.005 Å
• c: 7.95 ± 0.005 Å
• α: 90 ± 0.005°
• β: 90 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 3015 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 68
• Hermann-Mauguin space group symbol: C c c a :2
• Hall space group symbol: -C 2a 2ac
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0898
• Weighted residual factors for all reflections included in the refinement: 0.1125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No