2-[2-(1H-Imidazol-1-Yl)Ethyl]-4-(3-Pyridinyl)-1(2H)-Phthalazinone

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Properties Simple | Detailed

Formula C18H15N5O
IUPAC Name 2-(2-imidazol-1-ylethyl)-4-(3-pyridyl)phthalazin-1-one
Molecular Mass 317.345 g·mol−1
Heat of Formation 349.4 ± 16.7 kJ·mol−1
Dipole Moment 2.18 ± 1.08 D
Volume 371.4 Å 3
Surface Area 308.78 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -1.01 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(2-(1-imidazolyl)ethyl)-4-(3-pyridyl)-1(2h)-phthalazinone
  • 2-(2-imidazol-1-ylethyl)-4-(3-pyridyl)phthalazin-1-one
  • 2-(2-imidazol-1-ylethyl)-4-pyridin-3-yl-phthalazin-1-one
  • 2-(2-imidazol-1-ylethyl)-4-pyridin-3-ylphthalazin-1-one
  • 2-[2-(1-imidazolyl)ethyl]-4-(3-pyridyl)-1-phthalazinone
  • 2-ieppo
CAS Number(s)
  • 137381-31-8
InChIKey FYSGNCKTVYFUHA-UHFFFAOYSA-N
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