Information card for entry 7251636

Structure parameters

• Formula: C15.5 H9 B Cl F3 N O
• Calculated formula: C15.5 H10 B Cl F3 N O
• Title of publication: Development of unsymmetrical boron complexes bearing (iso)quinolylphenol ligands and their halogenated derivatives; crystal polymorphism for white-light-emitting properties.
• Authors of publication: Nakano, Takeo; Ichikawa, Shota; Inaba, Ryoto; Sumida, Akifumi; Hamasaki, Atom; Imoto, Hiroaki; Naka, Kensuke
• Journal of publication: Physical chemistry chemical physics : PCCP
• Year of publication: 2026
• Journal volume: 28
• Journal issue: 7
• Pages of publication: 4626 - 4635
• a: 6.7344 ± 0.0002 Å
• b: 8.3673 ± 0.0003 Å
• c: 12.9637 ± 0.0005 Å
• α: 71.272 ± 0.003°
• β: 81.388 ± 0.003°
• γ: 84.912 ± 0.003°
• Cell volume: 683.37 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0588
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.1406
• Weighted residual factors for all reflections included in the refinement: 0.1469
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No