Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2311349
Preview
| Coordinates | 2311349.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H6 O7 Rb2 |
|---|---|
| Calculated formula | C6 H6 O7 Rb2 |
| SMILES | C(=O)(CC(C(=O)[O-])(O)CC(=O)O)[O-].[Rb+].[Rb+] |
| Title of publication | Crystal structure of dirubidium hydrogen citrate from laboratory X-ray powder diffraction data and DFT comparison. |
| Authors of publication | Rammohan, Alagappa; Kaduk, James A. |
| Journal of publication | Acta crystallographica. Section E, Crystallographic communications |
| Year of publication | 2017 |
| Journal volume | 73 |
| Journal issue | Pt 1 |
| Pages of publication | 92 - 95 |
| a | 5.978 Å |
| b | 15.0961 Å |
| c | 5.3207 Å |
| α | 90° |
| β | 93.9354° |
| γ | 90° |
| Cell volume | 479.032 Å3 |
| Cell temperature | 300 K |
| Number of distinct elements | 4 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 245815 (current) | 2019-12-25 | cif/ Adding structures of 2311348, 2311349 via cif-deposit CGI script. |
2311349.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.