Information card for entry 7135090

Structure parameters

• Chemical name: Copper(I)Phen
• Formula: C28.6 H22.9 Cl Cu N6.3
• Calculated formula: C24 H16 Cl Cu N4
• Title of publication: Photocatalytic carboxylation of aryl halides/alkenes with a copper(I) complex bypassing the demand for dual catalysts.
• Authors of publication: David, A. John; Seethapathy, Logeshwari; Kumar, S. Vijay; Das, Rajorshi; Das, Anjan
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 90
• Pages of publication: 17677 - 17680
• a: 23.24 ± 0.002 Å
• b: 30.2 ± 0.003 Å
• c: 7.495 ± 0.0006 Å
• α: 90°
• β: 97.687 ± 0.003°
• γ: 90°
• Cell volume: 5213.1 ± 0.8 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0809
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1339
• Weighted residual factors for all reflections included in the refinement: 0.1426
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No