3-(3-Iodophenyl)-3-(Trifluoromethyl)-3H-Diazirene

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Formula C8H4F3IN2
IUPAC Name 3-(3-iodophenyl)-3-(trifluoromethyl)diazirine
Molecular Mass 312.030 g·mol−1
Heat of Formation -69.2 ± 16.7 kJ·mol−1
Dipole Moment 2.56 ± 1.08 D
Volume 237.66 Å 3
Surface Area 220.86 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 1.35 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(3-iodophenyl)-3-(trifluoromethyl)-1,2-diazirine
  • 3-(trifluoromethyl)-3-(3-iodophenyl)diazirine
  • 3-(trifluoromethyl)-3-(m-iodophenyl)diazirine
  • 3h-diazirine, 3-(3-iodophenyl)-3-(trifluoromethyl)-
  • tfmipda
CAS Number(s)
  • 81340-56-9
InChIKey GWDYFACLJZJKIB-UHFFFAOYSA-N
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