Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Chloride | HCID 312 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Acetonitrile | HCID 6342 | — |
| Reactant | Carbonate Ion | HCID 19660 | — |
| Reactant | Cesium cation | HCID 104967 | — |
| Reactant | 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole | HCID 2783006 | — |
| Reactant | 5-Mercapto-Indan-2-Carboxylic Acid Methyl Ester | HCID 20766012 | — |
| Product | Methyl indane-2-carboxylate | HCID 9964238 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (4/10) |
|---|
| ORD ID | ord-909eaf02e18b441892a7f256baaab9f3 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (4/10) |
|---|
