Ammonia → Bicyclo[4.2.0]octa-1,3,5,7-tetraene-7-carbonitrile
Reaction equation
[Cl:3][c:4]1[c:5]([CH:6]=[CH:7][C:8]#[N:9])[cH:10][cH:11][cH:12][cH:13]1.[Fe+3:23].[N+:19]([O-:20])([O-:21])=[O:22].[N+:24]([O-:25])([O-:26])=[O:27].[N+:28]([O-:29])([O-:30])=[O:31].[NH3:1].[NH4+:14].[Na:2].[O-:15][N+:16](=[O:17])[O-:18]>>[c:4]12[c:5]([cH:10][cH:11][cH:12][cH:13]1)[CH:6]=[C:7]2[C:8]#[N:9]Participants
7
Sources & evidence
- ORD record
- ord-18b9098fb341438eb6d46d4edf38c364
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
Loading…