1-Methylpyrazole

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Properties Simple | Detailed

Formula C4H6N2
IUPAC Name 1-methyl-4h-pyrazol-1-ium-4-ide
Molecular Mass 82.104 g·mol−1
Heat of Formation 186.6 ± 16.7 kJ·mol−1
Dipole Moment 2.92 ± 1.08 D
Volume 108.06 Å 3
Surface Area 121.29 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy 0.41 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-methyl-1h-pyrazole
  • 1h-pyrazole, 1-methyl-
  • pyrazole, 1-methyl-
  • zero/005846
CAS Number(s)
  • 930-36-9
InChIKey UQFQONCQIQEYPJ-UHFFFAOYSA-N
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DOI
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Elements H C N