1-(2-Pyridinyl)-1H-Benzotriazole

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Properties Simple | Detailed

Formula C11H8N4
IUPAC Name 1-(2-pyridyl)benzotriazol-1-ium-2-ide
Molecular Mass 196.208 g·mol−1
Heat of Formation 503.1 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 223.15 Å 3
Surface Area 216.37 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy -1.13 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-(2'-pyridyl)benzo-1,2,3-triazole
  • 1-(2-pyridyl)benzotriazole
  • 1-pyridin-2-ylbenzotriazole
  • 1h-benzotriazole, 1-(2-pyridinyl)-
  • oprea1_870601
CAS Number(s)
  • 13174-93-1
InChIKey CPWBWUGSSFRASR-UHFFFAOYSA-N
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Elements H C N