1,2-Dichloroethane → 5H-Dibenz(b,f)azepine-5-carbonitrile
Reaction equation
[CH3:16][N:17]([CH3:18])[C:19](=[O:20])[CH3:21].[Cl:25][CH2:26][CH2:27][Cl:28].[N:22]#[C:23][Cl:24].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1[CH:10]=[CH:9][c:8]1[c:7]([cH:15][cH:14][cH:13][cH:12]1)[NH:6]2>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1[CH:10]=[CH:9][c:8]1[c:7]([cH:15][cH:14][cH:13][cH:12]1)[N:6]2[C:16]#[N:17]Participants
5
Sources & evidence
- ORD record
- ord-80d8e56ebcbb4916a9072101a583a6ab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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