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

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Properties Simple | Detailed

Formula C8H6N4O5
IUPAC Name 1-[(z)-(5-nitro-2-furyl)methyleneamino]imidazolidine-2,4-dione
Molecular Mass 238.157 g·mol−1
Heat of Formation -169.7 ± 16.7 kJ·mol−1
Dipole Moment 5.13 ± 1.08 D
Volume 240.0 Å 3
Surface Area 227.48 Å 2
HOMO Energy -9.87 ± 0.55 eV
LUMO Energy 1.43 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(5-nitrofuran-2-yl)methylideneamino]imidazolidine-2,4-dione
  • furadoxyl
  • nitrofurantoine
InChIKey NXFQHRVNIOXGAQ-OQFOIZHKSA-N
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