Information card for entry 4338851

Structure parameters

• Common name: [MePN]Cu(PPh3)2
• Formula: C59 H65 Cu N O P3
• Calculated formula: C59 H65 Cu N O P3
• SMILES: [Cu]1([P](C(C)C)(C(C)C)c2c(N1c1ccccc1)cc(cc2)C)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.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: 11.099 ± 0.004 Å
• b: 21.513 ± 0.007 Å
• c: 21.933 ± 0.006 Å
• α: 90°
• β: 103.72 ± 0.03°
• γ: 90°
• Cell volume: 5088 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0732
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.0974
• Goodness-of-fit parameter for all reflections included in the refinement: 1.589
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No