Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ammonia | HCID 222 | — |
| Reactant | Ammonium | HCID 223 | — |
| Reactant | Chloride | HCID 312 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Cyanide | HCID 5975 | — |
| Reactant | Dimethylformamide | HCID 6228 | — |
| Reactant | Palladium | HCID 23938 | — |
| Reactant | Zinc(2+) | HCID 32051 | — |
| Reactant | Dibenzylidene acetone | HCID 95417 | — |
| Reactant | 2-Bromo-5-fluorotoluene | HCID 96743 | — |
| Product | 4-Fluoro-2-methylbenzonitrile | HCID 3826055 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (2/10) |
|---|
| ORD ID | ord-89fc271493b248bc81488a26ec3318cb |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (2/10) |
|---|
