Information card for entry 7713094

Structure parameters

• Formula: C43 H36 B Cu F4 N5 P
• Calculated formula: C43 H36 B Cu F4 N5 P
• Title of publication: Heteroleptic copper(I) complexes [Cu(dmp)(N^P)]BF4 for photoinduced atom-transfer radical addition reactions
• Authors of publication: Zhao, You-Hui; Li, Hai-Yan; Young, David James; Cao, Xiangqian; Zhu, Da-Liang; Ren, Zhi-Gang; Li, Hong-Xi
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 12.0193 ± 0.0003 Å
• b: 18.5661 ± 0.0006 Å
• c: 18.5678 ± 0.0008 Å
• α: 89.141 ± 0.003°
• β: 72.401 ± 0.003°
• γ: 75.892 ± 0.003°
• Cell volume: 3822.6 ± 0.2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0792
• Residual factor for significantly intense reflections: 0.0674
• Weighted residual factors for significantly intense reflections: 0.1706
• Weighted residual factors for all reflections included in the refinement: 0.1854
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No