4-(3-Amino-1H-1,2,4-Triazol-5-Yl)-N-Ethyl-2-Pyridinamine

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Properties Simple | Detailed

Formula C9H12N6
IUPAC Name 4-(5-amino-4-aza-2-azonia-1-azanidacyclopenta-2,4-dien-3-yl)-n-ethyl-pyridin-2-amine
Molecular Mass 204.232 g·mol−1
Heat of Formation 330.8 ± 16.7 kJ·mol−1
Dipole Moment 2.06 ± 1.08 D
Volume 241.79 Å 3
Surface Area 239.18 Å 2
HOMO Energy -8.69 ± 0.55 eV
LUMO Energy -0.72 ± eV
Point Group Symmetry C1
Synonyms
  • 2-pyridinamine, 4-(5-amino-1h-1,2,4-triazol-3-yl)-n-ethyl-
  • 3-aeptz
  • 3-amino-5-(2-(ethylamino)-4-pyridyl)-1,2,4-triazole
  • 4-(5-amino-1h-1,2,4-triazol-3-yl)-n-ethyl-2-pyridinamine
  • 4-(5-amino-2h-1,2,4-triazol-3-yl)-n-ethyl-2-pyridinamine
  • 4-(5-amino-2h-1,2,4-triazol-3-yl)-n-ethyl-pyridin-2-amine
  • 4-(5-amino-2h-1,2,4-triazol-3-yl)-n-ethylpyridin-2-amine
  • [4-(5-amino-2h-1,2,4-triazol-3-yl)-2-pyridyl]-ethyl-amine
CAS Number(s)
  • 77314-77-3
InChIKey RSIWCIZJVPDTSC-UHFFFAOYSA-N
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Elements H C N