Information card for entry 7050297

Structure parameters

• Chemical name: [Cu(F3)2](ClO4)2-0.67(H2O)
• Formula: C34 H33.35 Cl2 Cu N12 O8.67
• Calculated formula: C34 H32 Cl2 Cu N12 O8.673
• Title of publication: Syntheses, crystal structures and properties of copper(II) and cadmium(II) complexes containing novel tripodal ligand
• Authors of publication: Sun Wei-Yin; Jian Fan; Taka-aki Okamura; Norikazu Ueyama; Wei Zhao
• Journal of publication: New J.Chem.(Nouv.J.Chim.)
• Year of publication: 2004
• a: 19.693 ± 0.009 Å
• b: 8.996 ± 0.005 Å
• c: 20.591 ± 0.008 Å
• α: 90°
• β: 97.57 ± 0.03°
• γ: 90°
• Cell volume: 3616 ± 3 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 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: 0.1579
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.0885
• Weighted residual factors for all reflections included in the refinement: 0.108
• Goodness-of-fit parameter for all reflections included in the refinement: 0.744
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No