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Information card for entry 1559359
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 1559359.cif |
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Original paper (by DOI) | HTML |
Formula | C65 H58 Cl2 Si2 |
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Calculated formula | C65 H58 Cl2 Si2 |
SMILES | ClCCl.[Si](C#Cc1c2c3c(c4ccccc4c2c2c(cc(cc2C)C)C)c2c4c(c(c5c2cccc5)c2c(cc(cc2C)C)C)c(c2ccccc2c4c3c2c1cccc2)C#C[Si](C)(C)C)(C)(C)C |
Title of publication | Synthesis, crystal structure and charge transport characteristics of stable <i>peri</i>-tetracene analogues. |
Authors of publication | Mamada, Masashi; Nakamura, Ryota; Adachi, Chihaya |
Journal of publication | Chemical science |
Year of publication | 2020 |
Journal volume | 12 |
Journal issue | 2 |
Pages of publication | 552 - 558 |
a | 11.6467 ± 0.0003 Å |
b | 13.896 ± 0.0004 Å |
c | 16.8565 ± 0.0004 Å |
α | 92.613 ± 0.002° |
β | 102.408 ± 0.002° |
γ | 104.007 ± 0.002° |
Cell volume | 2571.41 ± 0.12 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0568 |
Residual factor for significantly intense reflections | 0.0464 |
Weighted residual factors for significantly intense reflections | 0.1257 |
Weighted residual factors for all reflections included in the refinement | 0.1329 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 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/1559359.html
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Users of the data should acknowledge the original authors of the
structural data.