Information card for entry 7135233

Structure parameters

• Formula: C39 H26 Cl2 N4 O
• Calculated formula: C39 H26 Cl2 N4 O
• Title of publication: Divergent synthesis of polycyclic (aza)fluorenes <i>via</i> condition-controlled tandem reaction of <i>ortho</i>-hydroxyphenyl-substituted indene-dienes.
• Authors of publication: Zhang, Yin-Fu; Zhang, Shuqi; Zhao, Yan; Xu, Jiying; Wang, Xiao-Qing; Han, Qiu-Xia; Zhang, Chuan-Bao; Zhao, Lili; Fu, Ji-Ya
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• a: 11.101 ± 0.0003 Å
• b: 10.5875 ± 0.0003 Å
• c: 26.8424 ± 0.0007 Å
• α: 90°
• β: 96.405 ± 0.001°
• γ: 90°
• Cell volume: 3135.14 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0692
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1644
• Weighted residual factors for all reflections included in the refinement: 0.1722
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No