Crystal Structure of 3
| Id | 1505186 |
| Common name | 3 |
| Chemical name | caffeine-citric acid 1/1 |
| a (Å) | 7.38740(10) |
| b (Å) | 8.3967(2) |
| c (Å) | 13.5053(3) |
| α (°) | 91.3330(10) |
| β (°) | 99.0400(10) |
| γ (°) | 99.5880(10) |
| V (Å3) | 814.72(3) |
| Space group | P -1 |
| Temperature (K) | 120(2) |
| Rint | 0.0382 |
Publication: Molecular Pharmaceutics (2007) 4, 3 347