Information card for entry 4000087

Structure parameters

• Common name: [Cu(tfac)(MHY)]
• Formula: C12 H14 Cu F3 O2
• Calculated formula: C12 H14 Cu F3 O2
• Title of publication: 2-Methyl-1-hexen-3-yne Lewis Base Stabilized β-Diketonate Copper(I) Complexes: X-ray Structures, Theoretical Study, and Low-Temperature Chemical Vapor Deposition of Copper Metal
• Authors of publication: Chen, T.-Y.; Vaissermann, J.; Ruiz, E.; Senateur, J. P.; Doppelt, P.
• Journal of publication: Chemistry of Materials
• Year of publication: 2001
• Journal volume: 13
• Journal issue: 11
• Pages of publication: 3993 - 4004
• a: 6.918 ± 0.004 Å
• b: 10.654 ± 0.007 Å
• c: 10.884 ± 0.003 Å
• α: 63.28 ± 0.04°
• β: 71.44 ± 0.04°
• γ: 71.07 ± 0.05°
• Cell volume: 663.5 ± 0.7 ų
• Cell temperature: 238 K
• Ambient diffraction temperature: 238 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 significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.0632
• Goodness-of-fit parameter for significantly intense reflections: 0.9909
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No