Information card for entry 4130144

Structure parameters

• Common name: [Cu2(Ph)DPFN]BPh4,3(o-C6H4F2)
• Formula: C78 H57 B Cu2 F8 N6
• Calculated formula: C78 H57 B Cu2 F8 N6
• Title of publication: Aryl Group Transfer from Tetraarylborato Anions to an Electrophilic Dicopper(I) Center and Mixed-Valence μ-Aryl Dicopper(I,II) Complexes.
• Authors of publication: Ziegler, Micah S.; Levine, Daniel S.; Lakshmi, K. V.; Tilley, T. Don
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 20
• Pages of publication: 6484 - 6491
• a: 9.9438 ± 0.0003 Å
• b: 16.1553 ± 0.0005 Å
• c: 20.9439 ± 0.0006 Å
• α: 87.583 ± 0.001°
• β: 76.604 ± 0.001°
• γ: 75.168 ± 0.001°
• Cell volume: 3163.41 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• 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: 0.0468
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No