Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7156525
Preview
| Coordinates | 7156525.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | KH-106 |
|---|---|
| Formula | C20 H33 B O2 S2 |
| Calculated formula | C20 H33 B O2 S2 |
| Title of publication | A hemithioindigo molecular motor for metal surface attachment. |
| Authors of publication | Hoffmann, Kerstin; Mayer, Peter; Dube, Henry |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2019 |
| Journal volume | 17 |
| Journal issue | 7 |
| Pages of publication | 1979 - 1983 |
| a | 19.3829 ± 0.0007 Å |
| b | 11.6584 ± 0.0004 Å |
| c | 12.0827 ± 0.0004 Å |
| α | 90° |
| β | 127.88 ± 0.001° |
| γ | 90° |
| Cell volume | 2155.08 ± 0.13 Å3 |
| Cell temperature | 103 ± 2 K |
| Ambient diffraction temperature | 103 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0342 |
| Residual factor for significantly intense reflections | 0.0282 |
| Weighted residual factors for significantly intense reflections | 0.0668 |
| Weighted residual factors for all reflections included in the refinement | 0.0719 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 225207 (current) | 2019-11-08 | cif/ Updating files of 7156524, 7156525, 7156526, 7156527, 7156528, 7156529 Original log message: Adding full bibliography for 7156524--7156529.cif. |
7156525.cif |
| 211588 | 2018-10-23 | cif/ Adding structures of 7156524, 7156525, 7156526, 7156527, 7156528, 7156529 via cif-deposit CGI script. |
7156525.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.