5-(2-Pyridinyl)-1H-Pyrazole-3-Carboxylic Acid

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Properties Simple | Detailed

Formula C9H7N3O2
IUPAC Name 5-(2-pyridyl)-4h-pyrazol-2-ium-4-ide-3-carboxylic acid
Molecular Mass 189.171 g·mol−1
Heat of Formation -28.0 ± 16.7 kJ·mol−1
Dipole Moment 2.66 ± 1.08 D
Volume 210.44 Å 3
Surface Area 209.94 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy 2.21 ± eV
Point Group Symmetry Cs
Synonyms
  • 5-(2-pyridyl)-2h-pyrazole-3-carboxylic acid
  • 5-pyridin-2-yl-2h-pyrazole-3-carboxylic acid
  • bas 09896575
  • bbv-032317
  • gl-0039
InChIKey SJBWHTBPIJXUFP-UHFFFAOYSA-N
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