2,2'-Triaz-1-Ene-1,3-Diylbis[4-(Trifluoromethyl)Benzonitrile]

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Properties Simple | Detailed

Formula C16H7F6N5
IUPAC Name 2-[(2e)-2-[2-cyano-5-(trifluoromethyl)phenyl]iminohydrazino]-4-(trifluoromethyl)benzonitrile
Molecular Mass 383.251 g·mol−1
Heat of Formation -620.7 ± 16.7 kJ·mol−1
Dipole Moment 1.05 ± 1.08 D
Volume 390.34 Å 3
Surface Area 360.86 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy -1.94 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-bctpt
  • 1,3-bis(2-cyano-5-(trifluoromethyl)phenyl)triazene
  • 2-[2-[2-cyano-5-(trifluoromethyl)phenyl]iminohydrazinyl]-4-(trifluoromethyl)benzonitrile
  • 2-[n'-[2-cyano-5-(trifluoromethyl)phenyl]iminohydrazino]-4-(trifluoromethyl)benzonitrile
  • benzonitrile, 2,2'-(1-triazene-1,3-diyl)bis(4-(trifluoromethyl)-
CAS Number(s)
  • 58458-08-5
InChIKey RDVUDZNNIJSPIJ-UHFFFAOYSA-N
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