Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1564729
Preview
| Coordinates | 1564729.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H61 B10 N3 O4 S |
|---|---|
| Calculated formula | C35.9987 H60.9972 B10 N3 O4 S |
| Title of publication | The method for synthesis of 2-sulfonium closo-decaborate anions derivatives with exo-polyhedral aminogroups |
| Authors of publication | Kubasov, A.S.; Turishev, E.S.; Golubev, A.V.; Bykov, A.Yu.; Zhizhin, K.Yu.; Kuznetsov, N.T. |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2020 |
| Journal volume | 507 |
| Pages of publication | 119589 |
| a | 14.9294 ± 0.0012 Å |
| b | 17.0837 ± 0.0011 Å |
| c | 20.114 ± 0.0015 Å |
| α | 90° |
| β | 111.673 ± 0.003° |
| γ | 90° |
| Cell volume | 4767.4 ± 0.6 Å3 |
| Cell temperature | 296 K |
| Ambient diffraction temperature | 296 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.23 |
| Residual factor for significantly intense reflections | 0.113 |
| Weighted residual factors for significantly intense reflections | 0.2983 |
| Weighted residual factors for all reflections included in the refinement | 0.3731 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.966 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269322 (current) | 2021-09-27 | cif/ Adding structures of 1564729 via cif-deposit CGI script. |
1564729.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.