Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ammonium | HCID 223 | — |
| Reactant | Chloride | HCID 312 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Toluene | HCID 1140 | — |
| Reactant | Tetrahydrofuran | HCID 8028 | — |
| Reactant | 3-Chloromethyl-4-(4-fluoro-benzoyl)-benzonitrile | HCID 9943434 | — |
| Reactant | HCID 178483492 | HCID 178483492 | — |
| Product | Citalopram | HCID 2771 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (2/10) |
|---|
| ORD ID | ord-c7bac2c4af3d4a7a89bdfdea21a4496d |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (2/10) |
|---|
