Crystal Structure of Theobromine 2,6-dihydroxybenzoic acid monohydrate
| Id | 7235244 |
| Common name | theobromine 2,6-dihydroxybenzoic acid monohydrate |
| Chemical name | theobrominium 2,6-dihydroxybenzoate monohydrate |
| a (Å) | 15.2976(3) |
| b (Å) | 6.84500(10) |
| c (Å) | 15.9300(3) |
| α (°) | 90 |
| β (°) | 115.911(3) |
| γ (°) | 90 |
| V (Å3) | 1500.38(6) |
| Temperature (K) | 131.8(3) |
| Rint | 0.0366 |
Publication: CrystEngComm (2019)