Calcium Cation → HCID 23289840, compound

HRID 1238899Notes

Reaction equation

HRID 1238899 reaction equation
[Ca+2:20].[Cl-:18].[Cl-:19].[F:1][c:2]1[c:3]([NH2:4])[cH:5][cH:6][c:7]([F:9])[cH:8]1.[O:10]=[C:11]1[CH:12]([C:16]#[N:17])[CH2:13][CH2:14][CH2:15]1>>[F:1][c:2]1[c:3]([NH:4][C:11]2=[C:12]([C:16]#[N:17])[CH2:13][CH2:14][CH2:15]2)[cH:5][cH:6][c:7]([F:9])[cH:8]1

Participants

5

Reactant 4

HCID 271Calcium CationHCID 312Chloride2×HCID 97092,4-DifluoroanilineHCID 98930Cyclopentanecarbonitrile, 2-oxo-

Product 1

HCID 23289840HCID 23289840, compound

Sources & evidence

ORD record
ord-35f6db2b56f042ed8ccb6d35941aa7f5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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