N-Cyanoimidazole

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Properties Simple | Detailed

Formula C4H3N3
IUPAC Name 4h-imidazol-3-ium-4-ylium-3-carbonitrile
Molecular Mass 93.087 g·mol−1
Heat of Formation 336.8 ± 16.7 kJ·mol−1
Dipole Moment 1.16 ± 1.08 D
Volume 113.3 Å 3
Surface Area 126.28 Å 2
HOMO Energy -10.38 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-imidazolecarbonitrile
  • 1h-imidazole-1-carbonitrile
  • imidazole-1-carbonitrile
CAS Number(s)
  • 36289-36-8
InChIKey SLPWXZZHNSOZPX-UHFFFAOYSA-N
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Elements H C N