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Information card for entry 2203483
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| Coordinates | 2203483.cif |
|---|---|
| Structure factors | 2203483.hkl |
| Original IUCr paper | HTML |
| Common name | BPQ-10BT |
|---|---|
| Chemical name | 3,3'-Didecyl-5,5'-bis(4-phenylquinolin-2-yl)-2,2'-bithienyl |
| Formula | C58 H64 N2 S2 |
| Calculated formula | C58 H64 N2 S2 |
| Title of publication | 3,3'-Didecyl-5,5'-bis(4-phenylquinolin-2-yl)-2,2'-bithienyl |
| Authors of publication | Benedict, Jason B.; Kaminsky, Werner; Tonzola, Christopher J. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2004 |
| Journal volume | 60 |
| Journal issue | 4 |
| Pages of publication | o530 - o531 |
| a | 17.464 ± 0.0009 Å |
| b | 9.471 ± 0.0005 Å |
| c | 29.823 ± 0.0019 Å |
| α | 90° |
| β | 104.153 ± 0.002° |
| γ | 90° |
| Cell volume | 4783 ± 0.5 Å3 |
| Cell temperature | 130 ± 2 K |
| Ambient diffraction temperature | 130 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.2508 |
| Residual factor for significantly intense reflections | 0.0665 |
| Weighted residual factors for significantly intense reflections | 0.1041 |
| Weighted residual factors for all reflections included in the refinement | 0.1508 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.855 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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Users of the data should acknowledge the original authors of the
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