Information card for entry 4338852

Structure parameters

• Common name: [CF3PN]Cu(PPh3)2
• Formula: C59 H62 Cu F3 N O P3
• Calculated formula: C59 H62 Cu F3 N O P3
• SMILES: [Cu]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[P](C(C)C)(c2ccc(C(F)(F)F)cc2N1c1ccccc1)C(C)C.O(CC)CC
• Title of publication: Long-lived and efficient emission from mononuclear amidophosphine complexes of copper.
• Authors of publication: Miller, Alexander J. M.; Dempsey, Jillian L.; Peters, Jonas C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 18
• Pages of publication: 7244 - 7246
• a: 11.101 ± 0.016 Å
• b: 21.7 ± 0.05 Å
• c: 22.3 ± 0.04 Å
• α: 90°
• β: 103.11 ± 0.07°
• γ: 90°
• Cell volume: 5232 ± 17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.1176
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1007
• Weighted residual factors for all reflections included in the refinement: 0.1078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.32
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No