Information card for entry 2011030

Structure parameters

• Formula: C28 H34 Cl6 Cu3 N6 O2
• Calculated formula: C28 H34 Cl6 Cu3 N6 O2
• SMILES: c1cccc2C[N]34Cc5cccc[n]5[Cu]4([n]12)([OH]CC3)Cl.Cl[Cu](Cl)([Cl-])[Cl-].c1cccc2C[N]34Cc5cccc[n]5[Cu]4([n]12)([OH]CC3)Cl
• Title of publication: Four copper(II) complexes with potentially tetradentate tripodal ligands
• Authors of publication: Kani, Yoshiyuki; Ohba, Shigeru; Ito, Sayo; Nishida, Yuzo
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 6
• Pages of publication: e233 - e235
• a: 23.377 ± 0.004 Å
• b: 9.204 ± 0.002 Å
• c: 16.361 ± 0.003 Å
• α: 90°
• β: 102.43 ± 0.01°
• γ: 90°
• Cell volume: 3437.7 ± 1.1 ų
• Cell temperature: 295 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for all reflections included in the refinement: 0.131
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes