Information card for entry 4350116

Structure parameters

• Common name: [Cu(L2)N3]ClO4
• Formula: C25 H39 Cl Cu N12 O6
• Calculated formula: C25 H39 Cl Cu N12 O6
• Title of publication: Structural and spectroscopic characterization of copper(II) complexes of a new bisamide functionalized imidazole tripod and evidence for the formation of a mononuclear end-on Cu-OOH species.
• Authors of publication: Cheruzel, Lionel E.; Cecil, Matthew R.; Edison, Sara E.; Mashuta, Mark S.; Baldwin, Michael J.; Buchanan, Robert M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 8
• Pages of publication: 3191 - 3202
• a: 12.003 ± 0.003 Å
• b: 12.133 ± 0.003 Å
• c: 13.327 ± 0.003 Å
• α: 116.114 ± 0.004°
• β: 103.539 ± 0.004°
• γ: 99.52 ± 0.004°
• Cell volume: 1612.2 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1663
• Residual factor for significantly intense reflections: 0.0645
• Weighted residual factors for significantly intense reflections: 0.113
• Weighted residual factors for all reflections included in the refinement: 0.1239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No