1-Allyl-N,N'-Dimethyl-1H-Pyrazole-4,5-Dicarboxamide

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Properties Simple | Detailed

Formula C10H14N4O2
IUPAC Name 2-allyl-n3,n4-dimethyl-pyrazol-2-ium-1-ide-3,4-dicarboxamide
Molecular Mass 222.244 g·mol−1
Heat of Formation -88.1 ± 16.7 kJ·mol−1
Dipole Moment 4.14 ± 1.08 D
Volume 277.2 Å 3
Surface Area 253.6 Å 2
HOMO Energy -9.48 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
Synonyms
  • 1-allyl-4,5-di(n-methylcarbamoyl)pyrazole
  • 1h-pyrazole-4,5-dicarboxamide, n,n'-dimethyl-1-(2-propenyl)-
  • 2-allyl-n,n'-dimethyl-pyrazole-3,4-dicarboxamide
  • 2-allyl-n,n'-dimethylpyrazole-3,4-dicarboxamide
  • iem 474
  • iem-474
  • n,n'-dimethyl-2-prop-2-enyl-pyrazole-3,4-dicarboxamide
  • n,n'-dimethyl-2-prop-2-enylpyrazole-3,4-dicarboxamide
CAS Number(s)
  • 21272-62-8
InChIKey KQEFVFVNXVZUSC-UHFFFAOYSA-N
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