Information card for entry 4120191

Structure parameters

• Common name: DippPh2PCuCl complex
• Chemical name: bis(mu2-Chloro)-bis( diphenyl(2,6-diisopropylphenyl)phosphane)-di-copper
• Formula: C48 H54 Cl1.54 Cu1.54 O0.46 P2
• Calculated formula: C48 H54 Cl1.542 Cu1.542 O0.458 P2
• Title of publication: Synthesis, Characterization, and Electrochemical Studies of PPh3-n (dipp)n(dipp = 2,6-Diisopropylphenyl): Steric and Electronic Effects on the Chemical and Electrochemical Oxidation of a Homologous Series of Triarylphosphines and the Reactivities of the Corresponding Phosphoniumyl Radical Cations
• Authors of publication: John P. Bullock; Alan M. Bond; René T. Boeré; Twyla M. Gietz; Tracey L. Roemmele; Sonja D. Seagrave; Jason D. Masuda; Masood Parvez
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 11205 - 11215
• a: 8.651 ± 0.004 Å
• b: 9.19 ± 0.004 Å
• c: 14.84 ± 0.007 Å
• α: 80.043 ± 0.005°
• β: 80.584 ± 0.005°
• γ: 67.536 ± 0.005°
• Cell volume: 1067.7 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Ambient diffracton pressure: 101 kPa
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1225
• Residual factor for significantly intense reflections: 0.1007
• Weighted residual factors for significantly intense reflections: 0.2598
• Weighted residual factors for all reflections included in the refinement: 0.2697
• Goodness-of-fit parameter for all reflections included in the refinement: 1.128
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No