Information card for entry 4312546

Structure parameters

• Formula: C48 H14 Cu2 F42 N4 O2
• Calculated formula: C48 H14 Cu2 F42 N4 O2
• Title of publication: Copper(I) Complexes of a Heavily Fluorinated β-Diketiminate Ligand: Synthesis, Electronic Properties, and Intramolecular Aerobic Hydroxylation
• Authors of publication: David S. Laitar; Casey J. N. Mathison; William M. Davis; Joseph P. Sadighi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 7354 - 7356
• a: 14.102 ± 0.007 Å
• b: 21.704 ± 0.01 Å
• c: 18.354 ± 0.008 Å
• α: 90°
• β: 99.907 ± 0.007°
• γ: 90°
• Cell volume: 5534 ± 4 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1235
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No