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Information card for entry 1553599
Preview
Coordinates | 1553599.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H32 |
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Calculated formula | C46 H32 |
SMILES | c1(c2c(c3c4ccccc4c(c3c(c2c2c1cccc2)c1ccccc1)c1ccc(cc1)C)c1ccccc1)c1ccc(cc1)C |
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 | 16.8864 ± 0.0004 Å |
b | 7.4906 ± 0.0002 Å |
c | 24.7447 ± 0.0007 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3129.94 ± 0.14 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 2 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0692 |
Residual factor for significantly intense reflections | 0.0504 |
Weighted residual factors for significantly intense reflections | 0.1175 |
Weighted residual factors for all reflections included in the refinement | 0.1276 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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