2,6-Dimethyl-4-Heptanethione

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Properties Simple | Detailed

Formula C9H18S
IUPAC Name 2,6-dimethylheptane-4-thione
Molecular Mass 158.304 g·mol−1
Heat of Formation -80.5 ± 16.7 kJ·mol−1
Dipole Moment 3.21 ± 1.08 D
Volume 232.5 Å 3
Surface Area 217.55 Å 2
HOMO Energy -8.49 ± 0.55 eV
LUMO Energy 2.18 ± eV
Point Group Symmetry C1
Synonyms
  • ,
  • -
  • 2
  • 4
  • 6
  • d
  • h
  • l
  • n
  • o
  • p
  • y
InChIKey BAYRURMNFHKDSZ-UHFFFAOYSA-N
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Elements H C S