Bicarbonate Ion → HCID 178509951, compound
Reaction equation
[N:1](=[N+:2]=[N-:3])[c:4]1[nH:5][c:6]([C:10](=[O:11])[OH:12])[c:7]([Cl:9])[n:8]1.[NH2:13][CH2:14][c:15]1[c:16]([F:32])[c:17]([O:22][c:23]2[cH:24][c:25]([C:26]#[N:27])[cH:28][c:29]([Cl:31])[cH:30]2)[c:18]([Cl:21])[cH:19][cH:20]1.[Na+:47].[O-:43][C:44]([OH:45])=[O:46].[OH:33][n:34]1[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[n:41][n:42]1>>[N:1](=[N+:2]=[N-:3])[c:4]1[nH:5][c:6]([C:10](=[O:12])[NH:13][CH2:14][c:15]2[c:16]([F:32])[c:17]([O:22][c:23]3[cH:24][c:25]([C:26]#[N:27])[cH:28][c:29]([Cl:31])[cH:30]3)[c:18]([Cl:21])[cH:19][cH:20]2)[c:7]([Cl:9])[n:8]1Participants
6
Sources & evidence
- ORD record
- ord-606a93a5d18f4fb980b60271d8b26f78
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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