Information card for entry 7720827

Structure parameters

• Formula: C49 H49 N5 O
• Calculated formula: C49 H49 N5 O
• Title of publication: Tailoring Exciplex Formation in Metal-Induced Supramolecular Organization
• Authors of publication: Le-Hoang, Giau; Guénée, Laure; Piguet, Claude
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 19.71021 ± 0.00019 Å
• b: 17.83878 ± 0.00016 Å
• c: 22.5695 ± 0.0002 Å
• α: 90°
• β: 94.1684 ± 0.0008°
• γ: 90°
• Cell volume: 7914.58 ± 0.13 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 ± 0.1 K
• Number of distinct elements: 4
• 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: 0.0584
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1294
• Weighted residual factors for all reflections included in the refinement: 0.1379
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No