1-{(E)-[(4-Hydroxy-5-Nitro-2-Furyl)Methylene]Amino}-2,4-Imidazolidinedione

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Properties Simple | Detailed

Formula C8H6N4O6
IUPAC Name 1-[(e)-(4-hydroxy-5-nitro-2-furyl)methyleneamino]imidazolidine-2,4-dione
Molecular Mass 254.156 g·mol−1
Heat of Formation -321.5 ± 16.7 kJ·mol−1
Dipole Moment 5.50 ± 1.08 D
Volume 254.88 Å 3
Surface Area 251.78 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy 1.20 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(4-hydroxy-5-nitro-2-furyl)methyleneamino]hydantoin
  • 1-[(4-hydroxy-5-nitro-2-furyl)methyleneamino]imidazolidine-2,4-dione
  • 1-[(4-hydroxy-5-nitro-furan-2-yl)methylideneamino]imidazolidine-2,4-dione
  • 2,4-imidazolidinedione, 1-(((4-hydroxy-5-nitro-2-furanyl)methylene)amino)-
  • 4-hydroxynitrofurantoin
CAS Number(s)
  • 76644-41-2
InChIKey FVAPZVJUBYDZAT-XNWCZRBMSA-N
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