Information card for entry 7134928

Structure parameters

• Formula: C38 H33 B N2 O
• Calculated formula: C38 H33 B N2 O
• Title of publication: Incorporating hybrid charge transfer within a boron/nitrogen/oxygen-embedded scaffold for efficient yellow electroluminescence.
• Authors of publication: Tan, Ji-Hua; Liu, Xiao-Long; Su, Yao-Zu; Xing, Longjiang; Huo, Yanping; Chen, Jia-Xiong; Zhao, Zujin; Chen, Wen-Cheng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 77
• Pages of publication: 14975 - 14978
• a: 10.5016 ± 0.0002 Å
• b: 11.4289 ± 0.0003 Å
• c: 13.5999 ± 0.0003 Å
• α: 104.793 ± 0.002°
• β: 93.4087 ± 0.0019°
• γ: 114.921 ± 0.002°
• Cell volume: 1405.02 ± 0.06 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.1062
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No