Information card for entry 7244889

Structure parameters

• Formula: C62 H67 N5 O2 Si2
• Calculated formula: C62 H67 N5 O2 Si2
• Title of publication: Benzo[de]isoquinoline-1,3-dione condensed asymmetric azaacenes as strong acceptors
• Authors of publication: Zhou, Pengxin; Deng, Lanlan; Han, Zengtao; Zhao, Xiaolong; Zhang, Zhe; Huo, Shuhui
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 21
• Pages of publication: 13480 - 13486
• a: 8.5903 ± 0.0003 Å
• b: 17.6173 ± 0.0012 Å
• c: 19.5808 ± 0.0011 Å
• α: 112.588 ± 0.006°
• β: 92.604 ± 0.004°
• γ: 102.434 ± 0.004°
• Cell volume: 2644.7 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.1323
• Residual factor for significantly intense reflections: 0.0844
• Weighted residual factors for significantly intense reflections: 0.2208
• Weighted residual factors for all reflections included in the refinement: 0.2597
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No