({[3,5-Bis(Trifluoromethyl)Phenyl](Ethyl)Amino}Methylene)Malononitrile

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Properties Simple | Detailed

Formula C14H9F6N3
IUPAC Name 2-[[n-ethyl-3,5-bis(trifluoromethyl)anilino]methylene]propanedinitrile
Molecular Mass 333.232 g·mol−1
Heat of Formation -937.4 ± 16.7 kJ·mol−1
Dipole Moment 9.11 ± 1.08 D
Volume 353.86 Å 3
Surface Area 305.3 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy 1.29 ± eV
Point Group Symmetry C1
Synonyms
  • (3,5-di(alpha,alpha,alpha-trifluoromethyl)-n-ethylanilino)methylenemalononitrile
  • 2-[[[3,5-bis(trifluoromethyl)phenyl]-ethyl-amino]methylene]malononitrile
  • 2-[[[3,5-bis(trifluoromethyl)phenyl]-ethyl-amino]methylene]propanedinitrile
  • 2-[[[3,5-bis(trifluoromethyl)phenyl]-ethyl-amino]methylidene]propanedinitrile
  • 2-[[[3,5-bis(trifluoromethyl)phenyl]-ethylamino]methylene]propanedinitrile
  • mon 0856
  • mon-0856
  • propanedinitrile, (((3,5-bis(trifluoromethyl)phenyl)ethylamino)methylene)-
CAS Number(s)
  • 18181-26-5
InChIKey ZXMXCPQXWZXLAA-UHFFFAOYSA-N
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Elements H C N F