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115029-33-9

115029-33-9 structural image
Product Name: Octahydro-1,3,4,5,7,8-hexanitro-diimidazo[4,5-b:4',5'-e]pyrazine-2,6(1H,3H)-dione
Formula: C6H4N12O14
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COMPUTED DESCRIPTORS

Molecular Weight 468.17 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 0
Exact Mass 467.99699285 g/mol
Monoisotopic Mass 467.99699285 g/mol
Topological Polar Surface Area 329 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 826
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 4
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes