1-Nitro-2,2-Bis(Methylthio)Ethylene

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Properties Simple | Detailed

Formula C4H7NO2S2
IUPAC Name 1,1-bis(methylsulfanyl)-2-nitro-ethylene
Molecular Mass 165.234 g·mol−1
Heat of Formation 39.1 ± 16.7 kJ·mol−1
Dipole Moment 5.05 ± 1.08 D
Volume 184.01 Å 3
Surface Area 179.19 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
Synonyms
  • 1,1-bis(methylsulfanyl)-2-nitro-ethene
  • 1,1-bis(methylsulfanyl)-2-nitroethene
  • 1,1-bis(methylthio)-2-nitroethylene
  • [[1-(methylthio)-2-nitro-vinyl]thio]methane
  • ethene, 1,1-bis(methylthio)-2-nitro-
  • nitroketene dimethyl mercaptal
  • tl 00308
CAS Number(s)
  • 13623-94-4
InChIKey NXGHEDHQXXXTTP-UHFFFAOYSA-N
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