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Information card for entry 7233588
Preview
| Coordinates | 7233588.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | 5,5Bis(5nonylpyridin-2-yl)2,2-bithiophene |
|---|---|
| Formula | C34 H44 N2 S2 |
| Calculated formula | C34 H44 N2 S2 |
| Title of publication | 5,5'-Bis-(alkylpyridinyl)-2,2'-bithiophenes: synthesis, liquid crystalline behaviour and charge transport |
| Authors of publication | Yulia A. Getmanenko; Shin-Woong Kang; Naresh Shakya; Chandra Pokhrel; Scott D. Bunge; Satyendra Kumar; Brett D. Ellman; Robert J. Twieg |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2014 |
| Journal volume | 2 |
| Pages of publication | 256 - 271 |
| a | 5.6 ± 0.0011 Å |
| b | 11.4 ± 0.002 Å |
| c | 11.92 ± 0.002 Å |
| α | 75.6 ± 0.03° |
| β | 87.4 ± 0.03° |
| γ | 76.2 ± 0.03° |
| Cell volume | 715.7 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 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 | 0.0897 |
| Residual factor for significantly intense reflections | 0.0592 |
| Weighted residual factors for significantly intense reflections | 0.1417 |
| Weighted residual factors for all reflections included in the refinement | 0.1644 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.863 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7233588.cif |
| 217878 | 2019-08-30 | cif/ Adding structures of 7233588 via cif-deposit CGI script. |
7233588.cif |
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Users of the data should acknowledge the original authors of the
structural data.