Information card for entry 7134686

Structure parameters

• Formula: C56 H56 B2 Cl6 F2
• Calculated formula: C56 H56 B2 Cl6 F2
• Title of publication: Efficient UV-matchable light-converting agent based on a space-conjugated di-triarylboron structure.
• Authors of publication: Wang, Zhen; Yang, Yuxuan; Fang, Luohan; Xie, Yangbin; Ma, Wenming; Zhang, Yahui; Sun, Chun-Lin; Zhang, Baoxin; Zhang, Xiaoxiang; Pan, Xiaobo
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 60
• Pages of publication: 11255 - 11258
• a: 8.5609 ± 0.0004 Å
• b: 12.651 ± 0.0006 Å
• c: 13.4008 ± 0.0007 Å
• α: 64.065 ± 0.005°
• β: 78.326 ± 0.004°
• γ: 88.076 ± 0.004°
• Cell volume: 1275.71 ± 0.12 ų
• Cell temperature: 149.99 ± 0.1 K
• Ambient diffraction temperature: 149.99 ± 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: 0.1337
• Residual factor for significantly intense reflections: 0.1046
• Weighted residual factors for significantly intense reflections: 0.3064
• Weighted residual factors for all reflections included in the refinement: 0.335
• Goodness-of-fit parameter for all reflections included in the refinement: 1.246
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No