2,5,5-Trimethylheptane-3-Thione

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Formula C10H20S
IUPAC Name 2,5,5-trimethylheptane-3-thione
Molecular Mass 172.331 g·mol−1
Heat of Formation -86.8 ± 16.7 kJ·mol−1
Dipole Moment 2.80 ± 1.08 D
Volume 252.27 Å 3
Surface Area 223.51 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey FGJSBWQNAUIXMR-UHFFFAOYSA-N
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Elements H C S