Crystal Structure of 3-Carboxyphenylboronic acid--theophylline (1/1)
| Id | 2235895 |
| Common name | 3-Carboxyphenylboronic acid--theophylline (1/1) |
| Chemical name | 3-(Dihydroxyboranyl)benzoic acid--1,3-dimethyl-7<i>H</i>-purine-2,6-dione (1/1) |
| a (Å) | 13.185(4) |
| b (Å) | 9.189(3) |
| c (Å) | 13.287(4) |
| α (°) | 90 |
| β (°) | 109.04(3) |
| γ (°) | 90 |
| V (Å3) | 1521.7(9) |
| Space group | P 1 21/c 1 |
| Temperature (K) | 290(2) |
| Rint | 0.0496 |
Publication: Acta Crystallographica Section E (2012) 68, 8 o2320