Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Water | HCID 962 | — |
| Reactant | Propylenediamine | HCID 6567 | — |
| Reactant | Dodecanenitrile | HCID 17092 | — |
| Reactant | Titanium cation (4+) | HCID 114942 | — |
| Reactant | Isopropanolate | HCID 3260420 | — |
| Reactant | 1,1-Propanediamine | HCID 14954072 | — |
| Product | HCID 178442810 | HCID 178442810 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-78e08174365042efb44d6cf1df3a577c |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
