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Information card for entry 1555428
Preview
| Coordinates | 1555428.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H12 Cl2 O S2 |
|---|---|
| Calculated formula | C15 H12 Cl2 O S2 |
| Title of publication | Synthesis of α,α-Disulfenylated Aldehydes via Oxidative Transformation of Tertiary Amines. |
| Authors of publication | Huang, Xin; Wang, Jichao; Ni, Zhangqin; Wang, Sichang; Pan, Yuanjiang |
| Journal of publication | Organic letters |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 21 |
| Pages of publication | 5488 - 5491 |
| a | 6.9371 ± 0.0004 Å |
| b | 9.8082 ± 0.0006 Å |
| c | 22.3442 ± 0.0012 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1520.31 ± 0.15 Å3 |
| Cell temperature | 171.5 K |
| Ambient diffraction temperature | 171.5 K |
| Number of distinct elements | 5 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.0339 |
| Residual factor for significantly intense reflections | 0.029 |
| Weighted residual factors for significantly intense reflections | 0.0747 |
| Weighted residual factors for all reflections included in the refinement | 0.0778 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.095 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 238656 (current) | 2019-11-24 | cif/ Adding structures of 1555428 via cif-deposit CGI script. |
1555428.cif |
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