Cyanocyclohexene

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Properties Simple | Detailed

Formula C7H9N
IUPAC Name cyclohexene-1-carbonitrile
Molecular Mass 107.153 g·mol−1
Heat of Formation 105.0 ± 16.7 kJ·mol−1
Dipole Moment 4.56 ± 1.08 D
Volume 147.35 Å 3
Surface Area 153.5 Å 2
HOMO Energy -10.09 ± 0.55 eV
LUMO Energy -0.12 ± eV
Point Group Symmetry C1
Synonyms
  • 1-cyano-1-cyclohexene
  • 1-cyanocyclohexene
  • 1-cyclohexene-1-carbonitrile
  • 1-cyclohexenecarbonitrile
  • 1-cyclohexenyl cyanide
  • cyclohex-1-ene-1-carbonitrile
  • cyclohexenecarbonitrile
  • fr-0492
CAS Number(s)
  • 108031-42-1
  • 27456-25-3
  • 33292-55-6
  • 1855-63-6
InChIKey GTMWGXABXQTZRJ-UHFFFAOYSA-N
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Elements H C N