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Information card for entry 1541602
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| Coordinates | 1541602.cif |
|---|
| Chemical name | (C H Cl3) (H2 S)2 (H2 O)17 |
|---|---|
| Formula | C O17 S2 |
| Calculated formula | C O17 S2 |
| SMILES | C(Cl)(Cl)Cl.S.S.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O |
| Title of publication | On the Structure of Gas Hydrates |
| Authors of publication | von Stackelberg, M.; Mueller, H.R. |
| Journal of publication | Journal of Chemical Physics |
| Year of publication | 1951 |
| Journal volume | 19 |
| Pages of publication | 1319 - 1320 |
| a | 17.2 Å |
| b | 17.2 Å |
| c | 17.2 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5088.45 Å3 |
| Number of distinct elements | 3 |
| Space group number | 227 |
| Hermann-Mauguin space group symbol | F d -3 m :1 |
| Hall space group symbol | F 4d 2 3 -1d |
| 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. |
1541602.cif |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
1541602.cif |
| 172968 | 2016-01-03 | cif/ Adding structures of 1541602 via cif-deposit CGI script. |
1541602.cif |
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Users of the data should acknowledge the original authors of the
structural data.