Information card for entry 7720788

Structure parameters

• Formula: C43 H39 B N2 O2
• Calculated formula: C43 H39 B N2 O2
• Title of publication: Phosphorescence properties of boron β-diketiminate complexes modulated by spiro structures.
• Authors of publication: Suwa, Keisuke; Ito, Shunichiro; Tanaka, Kazuo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• a: 11.865 ± 0.006 Å
• b: 12.187 ± 0.006 Å
• c: 13.01 ± 0.006 Å
• α: 99.73 ± 0.005°
• β: 99.602 ± 0.004°
• γ: 108.243 ± 0.005°
• Cell volume: 1711.8 ± 1.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.1478
• Residual factor for significantly intense reflections: 0.0675
• Weighted residual factors for significantly intense reflections: 0.1293
• Weighted residual factors for all reflections included in the refinement: 0.1592
• Goodness-of-fit parameter for all reflections included in the refinement: 0.916
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No