Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ammonia | HCID 222 | — |
| Reactant | Potassium Cation | HCID 813 | — |
| Reactant | Nitrate | HCID 943 | — |
| Reactant | Sulfuric Acid | HCID 1118 | — |
| Reactant | Hexane | HCID 8058 | — |
| Reactant | Ethyl Acetate | HCID 8857 | — |
| Reactant | 4-Bromoisoquinoline | HCID 73743 | — |
| Product | 4-Bromo-5-nitroisoquinoline | HCID 271280 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (1/10) |
|---|
| ORD ID | ord-b7dc77841dc64f59a9f005d4bf2e0905 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (1/10) |
|---|
