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Information card for entry 1506316
Preview
Coordinates | 1506316.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H26 |
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Calculated formula | C32 H26 |
SMILES | c1cccc2c1C1(c3c(C42C2(c5ccccc5C(c5c2cccc5)(C4)C)C1)cccc3)C |
Title of publication | Photocatalytic formation of dimethyllepidopterene from 9,10-dimethylanthracene via electron-transfer oxidation. |
Authors of publication | Ohkubo, Kei; Iwata, Ryosuke; Miyazaki, Soushi; Kojima, Takahiko; Fukuzumi, Shunichi |
Journal of publication | Organic letters |
Year of publication | 2006 |
Journal volume | 8 |
Journal issue | 26 |
Pages of publication | 6079 - 6082 |
a | 9.544 ± 0.002 Å |
b | 11.546 ± 0.003 Å |
c | 10.453 ± 0.003 Å |
α | 90 ± 0.0008° |
β | 107.808 ± 0.0009° |
γ | 90 ± 0.0008° |
Cell volume | 1096.7 ± 0.5 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 2 |
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 | 0.0498 |
Residual factor for significantly intense reflections | 0.0396 |
Weighted residual factors for significantly intense reflections | 0.0988 |
Weighted residual factors for all reflections included in the refinement | 0.1054 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.121 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
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/1506316.html
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