Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2240857
Preview
| Coordinates | 2240857.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | sodium molybdate dihydrate |
|---|---|
| Chemical name | Disodium molybdenum(VI) oxide dihydrate |
| Formula | D4 Mo Na2 O6 |
| Calculated formula | D4 Mo Na2 O6 |
| SMILES | [Mo](=O)([O-])(=O)[O-].[Na+].[Na+].O([2H])[2H].O([2H])[2H] |
| Title of publication | Crystal structures of deuterated sodium molybdate dihydrate and sodium tungstate dihydrate from time-of-flight neutron powder diffraction |
| Authors of publication | Fortes, A. Dominic |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 7 |
| Pages of publication | 799 - 806 |
| a | 8.482961 ± 0.000014 Å |
| b | 10.56617 ± 0.000017 Å |
| c | 13.83195 ± 0.00003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1239.79 ± 0.004 Å3 |
| Cell temperature | 295 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 4 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Goodness-of-fit parameter for all reflections | 1.88 |
| Method of determination | powder diffraction |
| Diffraction radiation type | neutron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 139451 (current) | 2015-06-20 | cif/ Adding structures of 2240857, 2240858 via cif-deposit CGI script. |
2240857.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.