2-Hydroxy-N-(1H-1,2,4-Triazol-5-Yl)Benzamide

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Properties Simple | Detailed

Formula C9H8N4O2
IUPAC Name n-(4-aza-2-azonia-1-azanidacyclopenta-2,4-dien-3-yl)-2-hydroxy-benzamide
Molecular Mass 204.185 g·mol−1
Heat of Formation -40.8 ± 16.7 kJ·mol−1
Dipole Moment 7.24 ± 1.08 D
Volume 221.24 Å 3
Surface Area 218.04 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -1.12 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-hydroxy-n-(1h-[1,2,4]triazol-3-yl)-benzamide
  • 2-hydroxy-n-(2h-1,2,4-triazol-3-yl)benzamide
  • 2-hydroxy-n-1h-1,2,4-triazol-3-ylbenzamide
  • 3-(2-hydroxybenzamido)-1,2,4-triazole
  • 3-(n-salicyloyl)amino-1,2,4-triazole
  • 3-(n-salicyloylamino)-1,2,4-triazole
  • 3-salicylamido-1h-1,2,4-triazole
  • ald-n034042
  • bas 00444191
  • benzamide, 2-hydroxy-n-1h-1,2,4-triazol-3-yl
  • benzamide, 2-hydroxy-n-1h-1,2,4-triazol-3-yl-
  • cbdive_003663
  • enamine_000068
  • mark 1475
  • n-(1,2,4-triazol-3-yl)salicylamide
  • n-(2h-1,2,4-triazol-5-yl)salicylamide
  • oprea1_594282
  • oprea1_753061
  • salicylamide, n-(2h-1,2,4-triazol-5-yl)-
  • salicyloylaminotriazole
CAS Number(s)
  • 36411-52-6
  • 106803-52-5
InChIKey MZZYGYNZAOVRTG-UHFFFAOYSA-N
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