4-(3-(4-Cyanophenoxy)Propyl)-1H-Imidazole

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Properties Simple | Detailed

Formula C13H13N3O
IUPAC Name 4-(3-imidazol-3-ium-4-ylium-4-ylpropoxy)benzonitrile
Molecular Mass 227.262 g·mol−1
Heat of Formation 146.1 ± 16.7 kJ·mol−1
Dipole Moment 5.64 ± 1.08 D
Volume 282.65 Å 3
Surface Area 256.07 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[3-(1h-imidazol-4-yl)propoxy]benzonitrile
  • 4-[3-(3h-imidazol-4-yl)propoxy]benzonitrile
InChIKey XQNBJFUWFIHAMW-UHFFFAOYSA-N
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