Dichloroacetonitrile

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Properties Simple | Detailed

Formula C2HCl2N
IUPAC Name 2,2-dichloroacetonitrile
Molecular Mass 109.942 g·mol−1
Heat of Formation 67.3 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 107.36 Å 3
Surface Area 120.77 Å 2
HOMO Energy -11.83 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry Cs
Synonyms
  • 2,2-dichloroethanenitrile
  • acetonitrile, dichloro-
  • dichloromethyl cyanide
CAS Number(s)
  • 3018-12-0
InChIKey STZZWJCGRKXEFF-UHFFFAOYSA-N
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DOI
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Elements H C N Cl