Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Acetate | HCID 175 | — |
| Reactant | Dimethyl Sulfoxide | HCID 679 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | P-Xylene | HCID 7809 | — |
| Reactant | Diethanolamine | HCID 8113 | — |
| Reactant | 2-Chlorobenzonitrile | HCID 13391 | — |
| Reactant | Carbonate Ion | HCID 19660 | — |
| Reactant | Palladium Chloride | HCID 24290 | — |
| Reactant | Tolylboronic acid | HCID 79799 | — |
| Product | 2-Cyano-4'-methylbiphenyl | HCID 145512 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (4/10) |
|---|
| ORD ID | ord-a47e444582144cf69ef477474ab7cf7b |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (4/10) |
|---|
