Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Water | HCID 962 | — |
| Reactant | Acetonitrile | HCID 6342 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | 1-(Pyridin-2-yl)piperidin-4-amine | HCID 10197934 | — |
| Reactant | 1-(2-Chloroacetyl)-5-ethynylpyrrolidine-2-carbonitrile | HCID 71439599 | — |
| Product | Hydrochloric Acid | HCID 313 | — |
| Product | HCID 178436427 | HCID 178436427 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (3/10) |
|---|
| ORD ID | ord-a52ccf4007054e7f84d623d10b9a7f84 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (3/10) |
|---|
