Homophthalonitrile

Molecule SVG Image

Properties Simple | Detailed

Formula C9H6N2
IUPAC Name 2-phenylpropanedinitrile
Molecular Mass 142.157 g·mol−1
Heat of Formation 362.4 ± 16.7 kJ·mol−1
Dipole Moment 4.30 ± 1.08 D
Volume 181.97 Å 3
Surface Area 183.16 Å 2
HOMO Energy -10.42 ± 0.55 eV
LUMO Energy -0.90 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-phenylmalononitrile
  • malononitrile, phenyl-
  • phenyl-malonitril
  • phenylmalononitrile
  • propanedinitrile, phenyl-
CAS Number(s)
  • 3041-40-5
InChIKey OFCTVAYVCDCQDA-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N