Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2106598
Preview
| Coordinates | 2106598.cif |
|---|---|
| External links | PubChem |
| Chemical name | H N O3 (H2 O)3 |
|---|---|
| Formula | H7 N O6 |
| Calculated formula | H7 N O6 |
| Title of publication | Hydrogen bond studies. XCIV. Diaquaoxonium ion in nitric acid trihydrate |
| Authors of publication | Taesler, I.; Delaplane, R.G.; Olovsson, I. |
| Journal of publication | Acta Crystallographica B (24,1968-38,1982) |
| Year of publication | 1975 |
| Journal volume | 31 |
| Pages of publication | 1489 - 1492 |
| a | 9.4845 Å |
| b | 14.6836 Å |
| c | 3.4355 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 478.45 Å3 |
| Number of distinct elements | 3 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301802 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/10 Each referenced PubChem compound corresponds to the full crystal structure. |
2106598.cif |
| 176429 | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
2106598.cif |
| 151723 | 2015-07-14 | cif/ Adding structures of 2106598 via cif-deposit CGI script. |
2106598.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.