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Information card for entry 1570055
Preview
| Coordinates | 1570055.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H8 Cl2 O2 S3 |
|---|---|
| Calculated formula | C14 H8 Cl2 O2 S3 |
| Title of publication | 2,2′-Trisulfanediyldibenzoyl Chloride |
| Authors of publication | Aitken, R. Alan; Campbell, Alexandra H.; Fletcher, Chloé E.; Slawin, Alexandra M. Z. |
| Journal of publication | Molbank |
| Year of publication | 2023 |
| Journal volume | 2023 |
| Journal issue | 3 |
| Pages of publication | M1731 |
| a | 15.1011 ± 0.001 Å |
| b | 48.312 ± 0.003 Å |
| c | 4.2805 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3122.9 ± 0.4 Å3 |
| Cell temperature | 93 K |
| Ambient diffraction temperature | 93 K |
| Number of distinct elements | 5 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.0314 |
| Residual factor for significantly intense reflections | 0.0281 |
| Weighted residual factors for significantly intense reflections | 0.0705 |
| Weighted residual factors for all reflections included in the refinement | 0.072 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.924 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286824 (current) | 2023-10-06 | cif/ Adding structures of 1570055 via cif-deposit CGI script. |
1570055.cif |
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Users of the data should acknowledge the original authors of the
structural data.