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Information card for entry 2202208
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| Coordinates | 2202208.cif |
|---|---|
| Structure factors | 2202208.hkl |
| Original IUCr paper | HTML |
| Formula | C48 H26 S2 |
|---|---|
| Calculated formula | C48 H26 S2 |
| SMILES | c1(c2ccccc2ccc1C#Cc1sc(cc1)C#Cc1ccccc1)c1c2ccccc2ccc1C#Cc1sc(cc1)C#Cc1ccccc1 |
| Title of publication | (<i>R</i>)-2,2'-Bis{[5-(2-phenylethynyl)thienyl]ethynyl}-1,1'-binaphthyl |
| Authors of publication | Löhr, Sandra; Yonemura, Makiko; Orita, Akihiro; Imai, Nobuyuki; Akashi, Haruo; Junzo Otera |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2003 |
| Journal volume | 59 |
| Journal issue | 5 |
| Pages of publication | o594 - o595 |
| a | 12.2484 ± 0.0001 Å |
| b | 12.6553 ± 0.0001 Å |
| c | 11.5031 ± 0.0009 Å |
| α | 90° |
| β | 102.407 ± 0.005° |
| γ | 90° |
| Cell volume | 1741.42 ± 0.14 Å3 |
| Cell temperature | 123.1 K |
| Number of distinct elements | 3 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for significantly intense reflections | 0.03 |
| Weighted residual factors for all reflections included in the refinement | 0.094 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.179 |
| Diffraction radiation wavelength | 0.7107 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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