Calcium Cation → HCID 28401833, compound

HRID 1542980Notes

Reaction equation

HRID 1542980 reaction equation
[CH2:24]([OH:25])[CH3:26].[Ca+2:22].[Cl-:20].[Cl-:21].[Cl:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([C:8]#[N:9])[cH:10][cH:11][cH:12]2)[cH:13][cH:14][c:15]([N+:17]([O-:18])=[O:19])[cH:16]1.[Fe:27].[OH2:23]>>[Cl:1][c:2]1[c:3]([O:4][c:5]2[cH:6][c:7]([C:8]#[N:9])[cH:10][cH:11][cH:12]2)[cH:13][cH:14][c:15]([NH2:17])[cH:16]1

Participants

7

Reactant 6

HCID 271Calcium CationHCID 312Chloride2×HCID 702EthanolHCID 962WaterHCID 23925IronHCID 9194887HCID 9194887, compound

Product 1

HCID 28401833HCID 28401833, compound

Sources & evidence

ORD record
ord-21943c5b6bbb47df8afccd324cf06874
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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