참여 물질
| 역할 | 이름 | HCID | 투입량 |
|---|
| 반응물 | Ammonia | HCID 222 | — |
| 반응물 | Ammonium | HCID 223 | — |
| 반응물 | Chloride | HCID 312 | — |
| 반응물 | Water | HCID 962 | — |
| 반응물 | Cyanide | HCID 5975 | — |
| 반응물 | Dimethylformamide | HCID 6228 | — |
| 반응물 | Palladium | HCID 23938 | — |
| 반응물 | Zinc(2+) | HCID 32051 | — |
| 반응물 | Dibenzylidene acetone | HCID 95417 | — |
| 반응물 | 2-Bromo-5-fluorotoluene | HCID 96743 | — |
| 생성물 | 4-Fluoro-2-methylbenzonitrile | HCID 3826055 | — |
출처 및 근거
| DOI | 10.1039/C8SC04228D |
|---|
| 출처 데이터셋 | Training data from https://doi.org/10.1039/C8SC04228D (2/10) |
|---|
| ORD ID | ord-89fc271493b248bc81488a26ec3318cb |
|---|
| 출처 메모 | Training data from https://doi.org/10.1039/C8SC04228D (2/10) |
|---|