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72479-30-2

72479-30-2 structural image
Product Name: trisodium bis[4-[4,5-dihydro-4-[(2-hydroxy-5-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzene-1-sulphonato(3-)]ferrate(3-)
Formula: C32H24FeN10Na3O14S2+
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COMPUTED DESCRIPTORS

Molecular Weight 957.5 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 20
Rotatable Bond Count 6
Exact Mass 956.964431 g/mol
Monoisotopic Mass 956.964431 g/mol
Topological Polar Surface Area 400 Ų
Heavy Atom Count 62
Formal Charge 0
Complexity 703
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 6
Compound Is Canonicalized Yes