3-Methyl-1H-1,2,4-Triazol-5-Amine

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Properties Simple | Detailed

Formula C3H6N4
IUPAC Name 5-methyl-1h-1,2,4-triazol-3-amine
Molecular Mass 98.107 g·mol−1
Heat of Formation 185.0 ± 16.7 kJ·mol−1
Dipole Moment 2.58 ± 1.08 D
Volume 116.79 Å 3
Surface Area 131.25 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy 3.38 ± eV
Point Group Symmetry C1
Synonyms
  • (5-methyl-1h-1,2,4-triazol-3-yl)amine
  • 1h-1,2,4-triazol-3-amine, 5-methyl-
  • 3-amino-5-methyl-1,2,4-triazole
  • 3-amino-5-methyl-1h-1,2,4-triazole
  • 5-methyl-1h-1,2,4-triazol-3-amine
  • s-triazole, 3-amino-5-methyl-
  • zero/005105
CAS Number(s)
  • 4923-01-7
InChIKey FJRZOOICEHBAED-UHFFFAOYSA-N
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Elements H C N