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Information card for entry 8000194
Preview
| Coordinates | 8000194.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C9 H8 S6 |
|---|---|
| Calculated formula | C9 H8 S6 |
| Title of publication | Synthesis and Properties of New Tetrathiapentalene Donors Composed of Vinylogous TTFs |
| Authors of publication | Iwamoto, Shintaro; Watanabe, Shunsuke; Fueno, Hiroyuki; Tanaka, Kazuyoshi; Misaki, Yohji |
| Journal of publication | Chemistry Letters |
| Year of publication | 2008 |
| Journal volume | 37 |
| Journal issue | 1 |
| Pages of publication | 82 |
| a | 7.486 ± 0.003 Å |
| b | 19.419 ± 0.008 Å |
| c | 8.545 ± 0.004 Å |
| α | 90° |
| β | 94.541 ± 0.002° |
| γ | 90° |
| Cell volume | 1238.3 ± 0.9 Å3 |
| Cell temperature | 293.1 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 significantly intense reflections | 0.044 |
| Weighted residual factors for all reflections included in the refinement | 0.115 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176466 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8000194.cif |
| 94327 | 2014-01-22 | cif/ Adding structures of 8000194 via cif-deposit CGI script. |
8000194.cif |
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Users of the data should acknowledge the original authors of the
structural data.