1,1,1-Tricyanoethane

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Properties Simple | Detailed

Formula C5H3N3
IUPAC Name ethane-1,1,1-tricarbonitrile
Molecular Mass 105.097 g·mol−1
Heat of Formation 396.6 ± 16.7 kJ·mol−1
Dipole Moment 3.54 ± 1.08 D
Volume 136.29 Å 3
Surface Area 147.68 Å 2
HOMO Energy -13.53 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C3v
Synonyms
  • 1,1,1-ethanetricarbonitrile
CAS Number(s)
  • 10359-20-3
InChIKey VWUGKRZGPYWAPN-UHFFFAOYSA-N
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Elements H C N