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Information card for entry 1555530
Preview
Coordinates | 1555530.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H22 |
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Calculated formula | C38 H22 |
SMILES | Cc1cc2c3ccc4cccc5c6c7ccc(C)cc7c7ccc8cccc9c(c2cc1)c(c3c45)c6c7c89 |
Title of publication | Dinaphthozethrene and Diindenozethrene: Synthesis, Structural Analysis, and Properties. |
Authors of publication | Hsieh, Ya-Chu; Wu, Tsun-Cheng; Li, Jen-Yi; Chen, Yi-Ting; Kuo, Ming-Yu; Chou, Pi-Tai; Wu, Yao-Ting |
Journal of publication | Organic letters |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 8 |
Pages of publication | 1868 - 1871 |
a | 17.4392 ± 0.0006 Å |
b | 7.3355 ± 0.0002 Å |
c | 17.5242 ± 0.0006 Å |
α | 90° |
β | 94.296 ± 0.003° |
γ | 90° |
Cell volume | 2235.49 ± 0.12 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 2 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.06 |
Residual factor for significantly intense reflections | 0.0454 |
Weighted residual factors for significantly intense reflections | 0.1209 |
Weighted residual factors for all reflections included in the refinement | 0.1321 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1555530.html
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