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CIF Information Card
Information card for 2013131
2013130 << 2013131 >> 2013132Preview
|
Coordinates |
2013131.cif |
|
Structure factors |
2013131.hkl |
Structure parameters
| Formula | - C5 H5 B Br N O2 - |
| Calculated formula | - C5 H5 B Br N O2 - |
| Title of publication | 2-(6-bromopyridin-3-yl)-4,4,5,5-tetramethyl-1,3-dioxaborolane and (6-bromopyridin-3-yl)boronic acid, new bifunctional building blocks for combinatorial chemistry |
| Authors of publication | Sopková-de Oliveira Santos, Jana; Lancelot, Jean-Charles; Bouillon, Alexandre; Rault, Sylvain |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2003 |
| Journal volume | 59 |
| Pages of publication | o111 - o113 |
| a | 7.4991 ± 0.0009 Å |
| b | 6.9178 ± 0.0005 Å |
| c | 13.8251 ± 0.0015 Å |
| α | 90° |
| β | 96.574 ± 0.012° |
| γ | 90° |
| Cell volume | 712.49 ± 0.13 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |