Information card for entry 7710790

Structure parameters

• Formula: C30 H26 Si2
• Calculated formula: C30 H26 Si2
• Title of publication: PO-containing dibenzopentaarenes: facile synthesis, structures and optoelectronic properties
• Authors of publication: Yuan, Liuzhong; Liu, Yujia; Sun, Wenting; Ye, Kaiqi; Dou, Chuandong; Wang, Yue
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 10.9249 ± 0.0006 Å
• b: 10.8562 ± 0.0007 Å
• c: 19.2499 ± 0.0012 Å
• α: 90°
• β: 90.827 ± 0.002°
• γ: 90°
• Cell volume: 2282.9 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0802
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.1565
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No