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Information card for entry 1555900
Preview
| Coordinates | 1555900.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C63 H43 S16 |
|---|---|
| Calculated formula | C63 H43 S16 |
| Title of publication | Bis- and Tris-fused Tetrathiafulvalenes Extended with Anthracene-9,10-diylidene. |
| Authors of publication | Ogi, Daisuke; Fujita, Yusuke; Mori, Shigeki; Shirahata, Takashi; Misaki, Yohji |
| Journal of publication | Organic letters |
| Year of publication | 2016 |
| Journal volume | 18 |
| Journal issue | 22 |
| Pages of publication | 5868 - 5871 |
| a | 12.31 ± 0.004 Å |
| b | 14.356 ± 0.006 Å |
| c | 18.752 ± 0.008 Å |
| α | 82.396 ± 0.012° |
| β | 76.856 ± 0.013° |
| γ | 70.392 ± 0.012° |
| Cell volume | 3034 ± 2 Å3 |
| Cell temperature | 120 K |
| Ambient diffraction temperature | 120 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1122 |
| Residual factor for significantly intense reflections | 0.0848 |
| Weighted residual factors for significantly intense reflections | 0.1867 |
| Weighted residual factors for all reflections included in the refinement | 0.2049 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.134 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 239226 (current) | 2019-11-24 | cif/ Adding structures of 1555900 via cif-deposit CGI script. |
1555900.cif |
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Users of the data should acknowledge the original authors of the
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