Cyanocyclohexane

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Properties Simple | Detailed

Formula C7H11N
IUPAC Name cyclohexanecarbonitrile
Molecular Mass 109.169 g·mol−1
Heat of Formation 13.9 ± 16.7 kJ·mol−1
Dipole Moment 3.98 ± 1.08 D
Volume 152.81 Å 3
Surface Area 152.55 Å 2
HOMO Energy -11.33 ± 0.55 eV
LUMO Energy 4.33 ± eV
Point Group Symmetry Cs
Synonyms
  • cyclohexanecarboxylic acid nitrile
  • cyclohexanecarboxylic acid nitrite
  • cyclohexyl cyanide
  • fr-1371
  • hexahydrobenzonitrile
CAS Number(s)
  • 766-05-2
InChIKey VBWIZSYFQSOUFQ-UHFFFAOYSA-N
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Elements H C N