Information card for entry 1553600

Structure parameters

• Formula: C44 H28
• Calculated formula: C44 H28
• SMILES: c1(c2ccccc2)c2c3ccccc3c(c2c(c2c3ccccc3c(c12)c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: The synthesis, structure, and properties of 5,6,11,12-tetraarylindeno[1,2-b]fluorenes and their applications as donors for organic photovoltaic devices
• Authors of publication: Lo, Yuan-Chih; Ting, Hao-Chun; Li, Ya-Ze; Li, Yi-Hua; Liu, Shun-Wei; Huang, Kuo-Wei; Wong, Ken-Tsung
• Journal of publication: Organic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 5
• Pages of publication: 675
• a: 7.597 ± 0.0004 Å
• b: 8.9994 ± 0.0004 Å
• c: 11.0344 ± 0.0005 Å
• α: 78.931 ± 0.002°
• β: 75.805 ± 0.002°
• γ: 83.409 ± 0.002°
• Cell volume: 715.94 ± 0.06 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 2
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0955
• Residual factor for significantly intense reflections: 0.0504
• Weighted residual factors for significantly intense reflections: 0.1131
• Weighted residual factors for all reflections included in the refinement: 0.1326
• Goodness-of-fit parameter for all reflections included in the refinement: 0.988
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No