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Iron(III) Diethyldithiocarbamate

Catalog Number
ACM13963592-1
CAS Number
13963-59-2
Product Name
Iron(III) Diethyldithiocarbamate
Structure
Category
Magnetic Metal Complexes
IUPAC Name
N,N-diethylcarbamodithioate;iron(3+)
Molecular Weight
500.7g/mol
Molecular Formula
C15H30FeN3S6
Canonical SMILES
CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].CCN(CC)C(=S)[S-].[Fe+3]
InChI
InChI=1S/3C5H11NS2.Fe/c3*1-3-6(4-2)5(7)8;/h3*3-4H2,1-2H3,(H,7,8);/q;;;+3/p-3
InChI Key
WGPCJVLKOFIRMS-UHFFFAOYSA-K
Complexity
73
Covalently-Bonded Unit Count
4
EC Number
237-743-7
Exact Mass
500.011336g/mol
Formal Charge
0
Heavy Atom Count
25
Monoisotopic Mass
500.011336g/mol
Rotatable Bond Count
6
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