Information card for entry 4104076

Structure parameters

• Common name: [BP2]Cu(NTol2)
• Formula: C52.42 H80.84 B Cu N P2
• Calculated formula: C52.42 H80.84 B Cu N P2
• Title of publication: Three-Coordinate Copper(I) Amido and Aminyl Radical Complexes
• Authors of publication: Neal P. Mankad; William E. Antholine; Robert K. Szilagyi; Jonas C. Peters
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 3878 - 3880
• a: 16.3201 ± 0.0018 Å
• b: 16.3538 ± 0.0018 Å
• c: 18.849 ± 0.002 Å
• α: 90°
• β: 91.277 ± 0.002°
• γ: 90°
• Cell volume: 5029.5 ± 0.9 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: 0.0807
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1667
• Weighted residual factors for all reflections included in the refinement: 0.1813
• Goodness-of-fit parameter for all reflections included in the refinement: 1.282
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No