Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Acetone | HCID 180 | — |
| Reactant | Potassium Cation | HCID 813 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Acetonitrile | HCID 6342 | — |
| Reactant | 4-Chloro-2-methylphenol | HCID 14855 | — |
| Reactant | Carbonate Ion | HCID 19660 | — |
| Reactant | 2-Chloro-5-nitrobenzonitrile | HCID 85504 | — |
| Product | HCID 2085532 | HCID 2085532 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (5/10) |
|---|
| ORD ID | ord-dab66d05ffc44d02952e2cd64fd47ff1 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (5/10) |
|---|
