Information card for entry 1573722

Structure parameters

• Formula: C46 H38 Co F18 N10 P3
• Calculated formula: C46 H38 Co F18 N10 P3
• Title of publication: The role of [Re(η6-arene)2]+ substituents in electro- and photocatalytic water reduction with [Co(terpy)2]3+ catalysts
• Authors of publication: Csucker, Joshua; Grundmann, Nora Sophie; Blacque, Olivier; Spingler, Bernhard; Alberto, Roger
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 5
• Pages of publication: 1627 - 1633
• a: 14.7621 ± 0.0002 Å
• b: 16.5626 ± 0.0002 Å
• c: 20.9736 ± 0.0003 Å
• α: 90°
• β: 101.077 ± 0.001°
• γ: 90°
• Cell volume: 5032.48 ± 0.12 ų
• Cell temperature: 160 ± 0.1 K
• Ambient diffraction temperature: 160 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.0398
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0858
• Weighted residual factors for all reflections included in the refinement: 0.0892
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No