3,3-Dimethylheptane-4-Thione

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Properties Simple | Detailed

Formula C9H18S
IUPAC Name 3,3-dimethylheptane-4-thione
Molecular Mass 158.304 g·mol−1
Heat of Formation -68.0 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 226.38 Å 3
Surface Area 210.81 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry Cs
InChIKey VXTHJHNBRYHJIT-UHFFFAOYSA-N
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Elements H C S