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Information card for entry 1533171
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| Coordinates | 1533171.cif |
|---|
| Chemical name | (N D3) (D2 O)2 |
|---|---|
| Formula | D7 N O2 |
| Calculated formula | D7 N O2 |
| Title of publication | A high-resolution neutron powder diffraction study of ammonia dihydrate ((N D3) * 2(D2 O)) phase I |
| Authors of publication | Fortes, A.D.; Wood, I.G.; Brodholt, J.P.; Alfredsson, M.; Knight, K.S.; Vocadlo, L.; McGrady, G.S. |
| Journal of publication | Journal of Chemical Physics |
| Year of publication | 2003 |
| Journal volume | 119 |
| Pages of publication | 10806 - 10813 |
| a | 7.091771 Å |
| b | 7.091771 Å |
| c | 7.091771 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 356.668 Å3 |
| Number of distinct elements | 3 |
| Space group number | 198 |
| Hermann-Mauguin space group symbol | P 21 3 |
| Hall space group symbol | P 2ac 2ab 3 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176429 (current) | 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. |
1533171.cif |
| 159282 | 2015-10-01 | cif/ Adding structures of 1533171 via cif-deposit CGI script. |
1533171.cif |
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Users of the data should acknowledge the original authors of the
structural data.