Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Acetate | HCID 175 | — |
| Reactant | Ammonia | HCID 222 | — |
| Reactant | Ammonium | HCID 223 | — |
| Reactant | Ethanol | HCID 702 | — |
| Reactant | Dimethylformamide | HCID 6228 | — |
| Reactant | Phosphorus oxychloride | HCID 24813 | — |
| Reactant | HCID 178510337 | HCID 178510337 | — |
| Reactant | HCID 178516071 | HCID 178516071 | — |
| Product | 4-Chloro-nicotinonitrile | HCID 13411112 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-daf24ccd77d2401bb0ea8c3b879b11f6 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
