[(Carbamimidoyldisulfanyl)Methyl]Benzene

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Properties Simple | Detailed

Formula C8H10N2S2
IUPAC Name 2-benzylsulfanylisothiourea
Molecular Mass 198.308 g·mol−1
Heat of Formation 171.9 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 236.54 Å 3
Surface Area 226.07 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 1.84 ± eV
Point Group Symmetry C1
Synonyms
  • benzyldisulfanylformamidine
  • carbamo(dithioperox)imidic acid, phenylmethyl ester
  • phenylmethyldisulfanylformamidine
  • s-benzylthioisothiourea
CAS Number(s)
  • 28356-14-1
InChIKey DFXJMJHWFFKBFB-UHFFFAOYSA-N
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Elements H S C N