Information card for entry 4114568

Structure parameters

• Formula: C56 H54 B Cu F4 N3 O2.5 P2
• Calculated formula: C56 H49 B Cu F5 N3 O3 P2
• Title of publication: Simple Cu(I) Complexes with Unprecedented Excited-State Lifetimes
• Authors of publication: Douglas G. Cuttell; Shan-Ming Kuang; Phillip E. Fanwick; David R. McMillin; Richard A. Walton
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 6 - 7
• a: 12.9326 ± 0.0003 Å
• b: 14.321 ± 0.0003 Å
• c: 15.1443 ± 0.0004 Å
• α: 105.883 ± 0.0013°
• β: 99.3086 ± 0.0013°
• γ: 106.945 ± 0.0012°
• Cell volume: 2490.13 ± 0.11 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for all reflections included in the refinement: 0.154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MO-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No