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Information card for entry 4001536
Preview
Coordinates | 4001536.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H54 S2 |
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Calculated formula | C34 H54 S2 |
SMILES | CCCCCCCCCCCCc1c2sccc2c(c2c1ccs2)CCCCCCCCCCCC |
Title of publication | Synthesis and Thin-Film Transistor Performance of Poly(4,8-didodecylbenzo[1,2-b:4,5-b‘]dithiophene) |
Authors of publication | Pan, Hualong; Li, Yuning; Wu, Yiliang; Liu, Ping; Ong, Beng S.; Zhu, Shiping; Xu, Gu |
Journal of publication | Chemistry of Materials |
Year of publication | 2006 |
Journal volume | 18 |
Journal issue | 14 |
Pages of publication | 3237 |
a | 21.408 ± 0.0005 Å |
b | 4.8379 ± 0.0001 Å |
c | 17.0953 ± 0.0004 Å |
α | 90° |
β | 110.196 ± 0.001° |
γ | 90° |
Cell volume | 1661.7 ± 0.07 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 3 |
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 | 0.0748 |
Residual factor for significantly intense reflections | 0.062 |
Weighted residual factors for significantly intense reflections | 0.2028 |
Weighted residual factors for all reflections included in the refinement | 0.2188 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
178377 (current) | 2016-03-21 | cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00. |
4001536.cif |
120073 | 2014-07-11 | Adding DOIs to range 4/00 structures. | 4001536.cif |
47605 | 2012-03-26 | ../uploads/cif-deposit/cod/cif Adding structures of 4001536 via cif-deposit CGI script. |
4001536.cif |
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Users of the data should acknowledge the original authors of the
structural data.