Calcium Cation → HCID 57597297, compound

HRID 1546862Notes

Reaction equation

HRID 1546862 reaction equation
[CH2:40]([OH:41])[CH3:42].[CH3:1][c:2]1[cH:3][c:4]([NH:16][c:17]2[c:18]3[c:19]([n:20][cH:21][n:22]2)[cH:23][n:24](-[c:26]2[cH:27][cH:28][c:29]([N+:32]([O-:33])=[O:34])[cH:30][cH:31]2)[n:25]3)[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][n:11][c:12]([CH3:15])[cH:13][cH:14]1.[Ca+2:37].[Cl-:35].[Cl-:36].[Fe:38].[OH2:39]>>[CH3:1][c:2]1[cH:3][c:4]([NH:16][c:17]2[c:18]3[c:19]([n:20][cH:21][n:22]2)[cH:23][n:24](-[c:26]2[cH:27][cH:28][c:29]([NH2:32])[cH:30][cH:31]2)[n:25]3)[cH:5][cH:6][c:7]1[O:8][c:9]1[cH:10][n:11][c:12]([CH3:15])[cH:13][cH:14]1

Participants

7

Reactant 6

HCID 271Calcium CationHCID 312Chloride2×HCID 702EthanolHCID 962WaterHCID 23925IronHCID 57597178HCID 57597178, compound

Product 1

HCID 57597297HCID 57597297, compound

Sources & evidence

ORD record
ord-abe77cc88fea41cd9270b858c570ca15
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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