Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Acetic Acid | HCID 176 | — |
| Reactant | Acetone | HCID 180 | — |
| Reactant | Chloride | HCID 312 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Iron | HCID 23925 | — |
| Reactant | Bisulfite | HCID 104748 | — |
| Reactant | HCID 53815307 | HCID 53815307 | — |
| Product | HCID 21543500 | HCID 21543500 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (3/10) |
|---|
| ORD ID | ord-89aab2bb721c4e0fbd530ea7cf1c30e2 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (3/10) |
|---|
