1,1,3-Tricyano-2-Amino-1-Propene

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Properties Simple | Detailed

Formula C6H4N4
IUPAC Name 2-aminoprop-1-ene-1,1,3-tricarbonitrile
Molecular Mass 132.123 g·mol−1
Heat of Formation 403.3 ± 16.7 kJ·mol−1
Dipole Moment 6.92 ± 1.08 D
Volume 168.41 Å 3
Surface Area 174.1 Å 2
HOMO Energy -10.10 ± 0.55 eV
LUMO Energy -1.61 ± eV
Point Group Symmetry C1
Synonyms
  • (1-amino-2-cyanoethylidene)malononitrile
  • 1,1,3-prop-1-enetricarbonitrile, 2-amino-
  • 1,1,3-tricyano-2-aminopropene
  • 1-propene-1,1,3-tricarbonitrile, 2-amino-
  • 2-amino-1,1,3-prop-1-enecarbonitrile
  • 2-amino-1,1,3-propenetricarbonitrile
  • 2-amino-1,1,3-tricyanopropene
  • 2-amino-1,1-3-tricyanopropene
  • 2-amino-1-propene-1,1,3-tricapbonitrile
  • 2-amino-1-propene-1,1,3-tricarbonitrile
  • 3-aminoprop-1-ene-1,1,3-tricarbonitrile
  • malononitrile, dimer
  • propene-1,1,3-tricarbonitrile, 2-amino
  • tcap (van)
  • u 9189
  • upjohn 9189
CAS Number(s)
  • 868-54-2
InChIKey BNHGNFYPZNDLAF-UHFFFAOYSA-N
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Elements H C N