1,2-Diisothiocyanatoethane

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Formula C4H4N2S2
IUPAC Name 1,2-diisothiocyanatoethane
Molecular Mass 144.218 g·mol−1
Heat of Formation 297.6 ± 16.7 kJ·mol−1
Dipole Moment 0.85 ± 1.08 D
Volume 169.18 Å 3
Surface Area 183.7 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C2
Synonyms
  • dimethylene diisothiocyanate
  • ebi
  • ebis
  • ethane, 1,2-diisothiocyanato- (9ci)
  • ethylene diisothiocyanate
  • ethylene-bis-thiurammono-sulfide
  • ethylenebis(isothiocyanate)
  • ethylenebisisothiocyanate
  • ethylenebisisothiocyanate sulfide
  • isothiocyanic acid, ethylene ester
CAS Number(s)
  • 3688-08-2
InChIKey KVUYSIIZYQUVMT-UHFFFAOYSA-N
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