Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ethanol | HCID 702 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Toluene | HCID 1140 | — |
| Reactant | Cyanide | HCID 5975 | — |
| Reactant | Dichloromethane | HCID 6344 | — |
| Reactant | Methanesulfonic Acid | HCID 6395 | — |
| Reactant | 2-Cyclohexylethanol | HCID 20508 | — |
| Reactant | Sulfuryl chloride | HCID 24648 | — |
| Reactant | Borohydride | HCID 28123 | — |
| Reactant | p-Toluenesulfonate | HCID 85570 | — |
| Reactant | 2-Cyclohexylacetaldehyde | HCID 316627 | — |
| Reactant | Oxido(dioxo)-lambda6-sulfane | HCID 656472 | — |
| Reactant | Trifluoromethanesulfonate | HCID 2758875 | — |
| Product | 3-Cyclohexylpropanenitrile | HCID 10749242 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (8/10) |
|---|
| ORD ID | ord-11ef9acc813b4d76ba6644abc8c6c240 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (8/10) |
|---|
