4-[2-(2-Methyl-2-Propanyl)-4-(3-Pyridinyl)-1H-Imidazol-5-Yl]Phenol

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Properties Simple | Detailed

Formula C18H19N3O
IUPAC Name 4-[2-tert-butyl-5-(3-pyridyl)imidazol-3-ium-2-ylium-4-yl]phenol
Molecular Mass 293.363 g·mol−1
Heat of Formation 75.4 ± 16.7 kJ·mol−1
Dipole Moment 6.71 ± 1.08 D
Volume 369.44 Å 3
Surface Area 325.64 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -0.25 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[2-tert-butyl-5-(3-pyridyl)-3h-imidazol-4-yl]phenol
  • cgp 8716
  • cgp-8716
  • phenol, 4-(2-(1,1-dimethylethyl)-5-(3-pyridinyl)-1h-imidazol-4-yl)-
CAS Number(s)
  • 84782-21-8
InChIKey MZGWIQCWWSGSRK-UHFFFAOYSA-N
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