Information card for entry 7134515

Structure parameters

• Formula: C44 H34 N5 P2 Re
• Calculated formula: C44 H34 N5 P2 Re
• Title of publication: Decanuclear {CuI6ReV4} clusters utilizing cyanido and nitrido molecular bridges as efficient ligand-modulated luminophores
• Authors of publication: Liberka, Michal; Gas, Piotr; Chorazy, Szymon
• Journal of publication: Chemical Communications
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 47
• Pages of publication: 8580 - 8583
• a: 17.768 ± 0.002 Å
• b: 9.5496 ± 0.001 Å
• c: 27.529 ± 0.003 Å
• α: 90°
• β: 102.419 ± 0.003°
• γ: 90°
• Cell volume: 4561.7 ± 0.9 ų
• Cell temperature: 125 ± 2 K
• Ambient diffraction temperature: 125 ± 2 K
• Number of distinct elements: 5
• 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: 0.0855
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1555
• Weighted residual factors for all reflections included in the refinement: 0.1643
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No