Information card for entry 1572249

Structure parameters

• Formula: C32 H47 Cu N O3 P3
• Calculated formula: C32 H47 Cu N O3 P3
• Title of publication: New mononuclear Cu(i) compounds: synthesis, characterization, and application to the electroreduction of CO2
• Authors of publication: Arévalo, Alma; Juárez-Francisco, Enrique; Roa, Diego A.; Flores-Alamo, Marcos; García, Juventino J.
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2024
• Journal volume: 14
• Journal issue: 18
• Pages of publication: 5394 - 5404
• a: 12.7674 ± 0.0005 Å
• b: 17.7058 ± 0.0007 Å
• c: 15.0682 ± 0.0006 Å
• α: 90°
• β: 105.218 ± 0.004°
• γ: 90°
• Cell volume: 3286.8 ± 0.2 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 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: 0.0722
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1289
• Weighted residual factors for all reflections included in the refinement: 0.1436
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No