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55613-78-0

55613-78-0 structural image
Product Name: trihydrogen bis[4-[4,5-dihydro-4-[(2-hydroxy-5-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonato(3-)]chromate(3-)
Formula: C32H21CrN10O14S2(-2)
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COMPUTED DESCRIPTORS

Molecular Weight 887.7 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 21
Rotatable Bond Count 5
Exact Mass 887.024168 g/mol
Monoisotopic Mass 887.024168 g/mol
Topological Polar Surface Area 390 Ų
Heavy Atom Count 59
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 2
Covalently-Bonded Unit Count 6
Compound Is Canonicalized Yes