Crystal Structure of MOnohydrate of caffeine-4HBA (1:1)
| Id | 7207674 |
| Common name | MOnohydrate of caffeine-4HBA (1:1) |
| Chemical name | MOnohydrate of caffeine-4HBA (1:1) |
| a (Å) | 7.2188(14) |
| b (Å) | 8.5282(17) |
| c (Å) | 13.827(3) |
| α (°) | 90.33(3) |
| β (°) | 101.29(3) |
| γ (°) | 107.57(3) |
| V (Å3) | 793.9(3) |
| Space group | P -1 |
| Temperature (K) | 110(2) |
| Rint | 0.0581 |
Publication: CrystEngComm (2012) 14, 7 2381