Information card for entry 4318907

Structure parameters

• Common name: 01169
• Chemical name: [3,5(CF3)2Ph(H2LiPr)Cu(MeCN)]
• Formula: C37 H42 Cu F6 N3
• Calculated formula: C37 H32 Cu F6 N3
• Title of publication: Copper Chemistry of β-Diketiminate Ligands: Monomer/Dimer Equilibria and a New Class of Bis(μ-oxo)dicopper Compounds
• Authors of publication: Douglas J. E. Spencer; Anne M. Reynolds; Patrick L. Holland; Brian A. Jazdzewski; Carole Duboc-Toia; Laurent Le Pape; Seiji Yokota; Yoshimitsu Tachi; Shinobu Itoh; William B. Tolman
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 6307 - 6321
• a: 9.4815 ± 0.0018 Å
• b: 13.068 ± 0.003 Å
• c: 14.499 ± 0.003 Å
• α: 96.998 ± 0.003°
• β: 95.087 ± 0.003°
• γ: 94.424 ± 0.003°
• Cell volume: 1769 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0796
• Residual factor for significantly intense reflections: 0.0558
• Weighted residual factors for significantly intense reflections: 0.1424
• Weighted residual factors for all reflections included in the refinement: 0.1541
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No