Information card for entry 7715291

Structure parameters

• Formula: C52 H72 Cu F6 N4 P
• Calculated formula: C52 H72 Cu F6 N4 P
• Title of publication: Introducing sterically demanding substituents and π-π-interactions into [Cu(P^P)(N^N)]⁺ complexes.
• Authors of publication: Meyer, Marco; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 12
• Pages of publication: 5453 - 5465
• a: 15.0492 ± 0.0004 Å
• b: 12.363 ± 0.0002 Å
• c: 27.1473 ± 0.0007 Å
• α: 90°
• β: 90.068 ± 0.002°
• γ: 90°
• Cell volume: 5050.8 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1058
• Residual factor for significantly intense reflections: 0.0882
• Weighted residual factors for significantly intense reflections: 0.1794
• Weighted residual factors for all reflections included in the refinement: 0.1961
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No