Information card for entry 7719116

Structure parameters

• Formula: C75 H62 B Cu F4 O P4
• Calculated formula: C72 H56 B Cu F4 P4
• Title of publication: Homoleptic copper(I)-bisphosphine complexes as photoredox catalysts.
• Authors of publication: Saha, Priya; Tomita, Ryunosuke; Tsuneda, Takao; Jiang, Pingyu; Taketsugu, Tetsuya; Jin, Mingoo; Huang, Dennis Chung-Yang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 30
• Pages of publication: 11725 - 11731
• a: 13.1933 ± 0.0001 Å
• b: 22.8744 ± 0.0001 Å
• c: 20.8119 ± 0.0001 Å
• α: 90°
• β: 100.153 ± 0.001°
• γ: 90°
• Cell volume: 6182.44 ± 0.06 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 153 K
• Number of distinct elements: 7
• 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: 0.0398
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for significantly intense reflections: 0.1055
• Weighted residual factors for all reflections included in the refinement: 0.1063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No