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CIF Information Card
Information card for 2300000
2237745 << 2300000 >> 2300001Preview
|
Coordinates |
2300000.cif |
Structure parameters
| Formula | - C6 H6 B Br O2 - |
| Calculated formula | - C6 B Br O2 - |
| Title of publication | A Novel strategy for ab-initio structure determination using micro-powder X-ray diffraction: Structure solution and refinement of 3-bromophenylboronic acid and tris(4-bromophenyl)boroxine |
| Authors of publication | Nattamai S. P. Bhuvanesh; Joseph H. Reibenspies; Peter L. Lee; Yuegang Zhang |
| Journal of publication | Journal of Applied Crystallography |
| Year of publication | 2005 |
| Journal volume | 38 |
| Pages of publication | 632 - 638 |
| a | 15.7797 ± 0.0004 Å |
| b | 5.3085 ± 0.0002 Å |
| c | 9.3757 ± 0.0003 Å |
| α | 90° |
| β | 93.357 ± 0.003° |
| γ | 90° |
| Cell volume | 784.02 ± 0.04 Å3 |
| Cell temperature | 295 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |