Information card for entry 7250674

Structure parameters

• Formula: C24 H18 N4
• Calculated formula: C24 H18 N4
• Title of publication: Thermally Activated Delayed Fluorescence in Aminoacene-linked Phenanthroline
• Authors of publication: Swathi Krishna, P. E.; Baiju, Hanock; Hariharan, Mahesh
• Journal of publication: Physical Chemistry Chemical Physics
• Year of publication: 2025
• a: 15.667 ± 0.003 Å
• b: 10.207 ± 0.002 Å
• c: 23.64 ± 0.005 Å
• α: 90°
• β: 101.832 ± 0.006°
• γ: 90°
• Cell volume: 3700 ± 1.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• 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: 0.2276
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for significantly intense reflections: 0.1493
• Weighted residual factors for all reflections included in the refinement: 0.2187
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No