Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Dimethylformamide | HCID 6228 | — |
| Reactant | Iodide Ion | HCID 30165 | — |
| Reactant | 1-(2-Chloroethyl)isochroman | HCID 10607966 | — |
| Reactant | HCID 178511850 | HCID 178511850 | — |
| Product | 1-(2-Cyanoethyl)isochroman | HCID 14203071 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-5e7ab5936e8e4cbeb4c06753e7825a52 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
