Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Methanol | HCID 887 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Acetonitrile | HCID 6342 | — |
| Reactant | 5-Bromopentanenitrile | HCID 79435 | — |
| Reactant | Methoxide | HCID 3826051 | — |
| Reactant | 1,1,1-Trifluoro-2-isothiocyanatoethane | HCID 13883777 | — |
| Reactant | HCID 21279827 | HCID 21279827 | — |
| Reactant | HCID 178418311 | HCID 178418311 | — |
| Product | HCID 54220720 | HCID 54220720 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (8/10) |
|---|
| ORD ID | ord-59939b1c4a294bb2b5f1baf048a24150 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (8/10) |
|---|
