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Details

Stereochemistry ACHIRAL
Molecular Formula 4C15H16Cl3N3O2.2Cl.Mn
Molecular Weight 1632.506
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICHLOROTETRAKISPROCHLORAZ MANGANESE

SMILES

[Cl-].[Cl-].[Mn++].CCCN(CCOC1=C(Cl)C=C(Cl)C=C1Cl)C(=O)N2C=CN=C2.CCCN(CCOC3=C(Cl)C=C(Cl)C=C3Cl)C(=O)N4C=CN=C4.CCCN(CCOC5=C(Cl)C=C(Cl)C=C5Cl)C(=O)N6C=CN=C6.CCCN(CCOC7=C(Cl)C=C(Cl)C=C7Cl)C(=O)N8C=CN=C8

InChI

InChIKey=OXOKTPUZOHPXSA-UHFFFAOYSA-L
InChI=1S/4C15H16Cl3N3O2.2ClH.Mn/c4*1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18;;;/h4*3,5,8-10H,2,4,6-7H2,1H3;2*1H;/q;;;;;;+2/p-2

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 2 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Mn
Molecular Weight 54.938045
Charge 2
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C15H16Cl3N3O2
Molecular Weight 376.665
Charge 0
Count
MOL RATIO 4 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
0128ETF5XZ
Record Status Validated (UNII)
Record Version