5-(2-Furyl)-4-{(E)-[(5-Nitro-2-Furyl)Methylene]Amino}-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione

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Formula C11H7N5O4S
IUPAC Name 3-(2-furyl)-4-[(e)-(5-nitro-2-furyl)methyleneamino]-1h-1,2,4-triazole-5-thione
Molecular Mass 305.269 g·mol−1
Heat of Formation 2039.8 ± 16.7 kJ·mol−1
Dipole Moment 1.74 ± 1.08 D
Volume 311.34 Å 3
Surface Area 290.6 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -1.10 ± eV
Point Group Symmetry C1
Synonyms
  • 3h-1,2,4-triazole-3-thione, 5-(2-furanyl)-2,4-dihydro-4-(((5-nitro-2-furanyl)methylene)amino)-
  • 4-(5-nitrofurfurylideneamino)-3-(furan-2)-5-mercapto-1,2,4-triazole
  • 4-nffmt
  • 5-(2-furyl)-4-[(5-nitro-2-furyl)methyleneamino]-2h-1,2,4-triazole-3-thione
  • 5-furan-2-yl-4-[(5-nitrofuran-2-yl)methylideneamino]-2h-1,2,4-triazole-3-thione
CAS Number(s)
  • 146173-56-0
InChIKey IYFQWGSBNWTKQO-WUXMJOGZSA-N
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