Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Bromide ion | HCID 259 | — |
| Reactant | Chloride | HCID 312 | — |
| Reactant | Toluene | HCID 1140 | — |
| Reactant | Acetyl chloride | HCID 6367 | — |
| Reactant | Acetophenone | HCID 7410 | — |
| Reactant | Aluminum Cation | HCID 104727 | — |
| Reactant | (4-Methyl-4-pentylcyclohexyl)benzene | HCID 13561252 | — |
| Reactant | HCID 178507002 | HCID 178507002 | — |
| Product | Benzoic Acid | HCID 243 | — |
| Product | Chloride | HCID 312 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (2/10) |
|---|
| ORD ID | ord-5275d700e6054602810324e520a6e3fb |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (2/10) |
|---|
