5,6-Dimethyl-3-Oxo-2,3-Dihydro-4-Pyridazinecarbonitrile

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Properties Simple | Detailed

Formula C7H7N3O
IUPAC Name 5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile
Molecular Mass 149.150 g·mol−1
Heat of Formation 73.3 ± 16.7 kJ·mol−1
Dipole Moment 6.46 ± 1.08 D
Volume 178.14 Å 3
Surface Area 178.14 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy -1.87 ± eV
Point Group Symmetry Cs
Synonyms
  • 2,3-dihydro-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile
  • 3-keto-5,6-dimethyl-2h-pyridazine-4-carbonitrile
  • 4-pyridazinecarbonitrile, 2,3-dihydro-5,6-dimethyl-3-oxo-
  • ae-641/25069011
CAS Number(s)
  • 40380-36-7
InChIKey WNSUWBPFLAQCMF-UHFFFAOYSA-N
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