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Information card for entry 2105409
Preview
| Coordinates | 2105409.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | (B N)3 Cl6 |
|---|---|
| Formula | B3 Cl6 N3 |
| Calculated formula | B3 Cl6 N3 |
| SMILES | ClN1B(Cl)N(Cl)B(N(B1Cl)Cl)Cl |
| Title of publication | On the crystal and molecular structure of hexachloroborazine |
| Authors of publication | Groeneveld, W.L.; Verschoor, G.C.; Haasnoot, J.G.; Romers, C. |
| Journal of publication | Acta Crystallographica B (24,1968-38,1982) |
| Year of publication | 1972 |
| Journal volume | 28 |
| Pages of publication | 2070 - 2073 |
| a | 8.847 Å |
| b | 8.847 Å |
| c | 10.321 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 699.591 Å3 |
| Number of distinct elements | 3 |
| Space group number | 146 |
| Hermann-Mauguin space group symbol | R 3 :H |
| Hall space group symbol | R 3 |
| 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. |
2105409.cif |
| 176768 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/10. |
2105409.cif |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2105409.cif |
| 84194 | 2013-05-02 | cif/ Adding structures of 2105409 via cif-deposit CGI script. |
2105409.cif |
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Users of the data should acknowledge the original authors of the
structural data.