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Information card for entry 1515429
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Coordinates | 1515429.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H53 N O2 Si2 |
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Calculated formula | C44 H53 N O2 Si2 |
Title of publication | A survey of electron-deficient pentacenes as acceptors in polymer bulk heterojunction solar cells |
Authors of publication | Shu, Ying; Lim, Yee-Fun; Li, Zhong; Purushothaman, Balaji; Hallani, Rawad; Kim, Jo Eun; Parkin, Sean R.; Malliaras, George G.; Anthony, John E. |
Journal of publication | Chemical Science |
Year of publication | 2011 |
Journal volume | 2 |
Journal issue | 2 |
Pages of publication | 363 |
a | 7.3935 ± 0.0002 Å |
b | 7.7475 ± 0.0002 Å |
c | 17.3713 ± 0.0004 Å |
α | 96.23 ± 0.001° |
β | 100.619 ± 0.001° |
γ | 94.648 ± 0.001° |
Cell volume | 967.02 ± 0.04 Å3 |
Cell temperature | 90 ± 0.2 K |
Ambient diffraction temperature | 90 ± 0.2 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 | 0.0826 |
Residual factor for significantly intense reflections | 0.0736 |
Weighted residual factors for significantly intense reflections | 0.19 |
Weighted residual factors for all reflections included in the refinement | 0.1962 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1515429.html
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Users of the data should acknowledge the original authors of the
structural data.