Calcium Cation → HCID 66726077, compound

HRID 1222656Notes

Reaction equation

HRID 1222656 reaction equation
[CH3:1][O:2][CH2:3][CH2:4][O:5][CH2:6][c:7]1[n:8][cH:9][c:10]([O:13][c:14]2[cH:15][c:16]([O:23][CH:24]3[CH2:25][CH2:26][O:27][CH2:28][CH2:29]3)[c:17]([N+:20]([O-:21])=[O:22])[cH:18][cH:19]2)[cH:11][cH:12]1.[CH3:33][CH2:34][OH:35].[Ca+2:32].[Cl-:30].[Cl-:31].[Fe:37].[OH2:36]>>[CH3:1][O:2][CH2:3][CH2:4][O:5][CH2:6][c:7]1[n:8][cH:9][c:10]([O:13][c:14]2[cH:15][c:16]([O:23][CH:24]3[CH2:25][CH2:26][O:27][CH2:28][CH2:29]3)[c:17]([NH2:20])[cH:18][cH:19]2)[cH:11][cH:12]1

Participants

7

Reactant 6

HCID 271Calcium CationHCID 312Chloride2×HCID 702EthanolHCID 962WaterHCID 23925IronHCID 66725952HCID 66725952, compound

Product 1

HCID 66726077HCID 66726077, compound

Sources & evidence

ORD record
ord-b191d27efd3a41dda3e8b7e60b424e0b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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