S-(1,1-Dimethylbutyl) 4,4-Dimethylpentanethioate

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Properties Simple | Detailed

Formula C13H26OS
IUPAC Name s-(1,1-dimethylbutyl) 4,4-dimethylpentanethioate
Molecular Mass 230.410 g·mol−1
Heat of Formation -436.4 ± 16.7 kJ·mol−1
Dipole Moment 0.58 ± 1.08 D
Volume 326.76 Å 3
Surface Area 293.12 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.73 ± eV
Point Group Symmetry C1
InChIKey RWTPTBHFSNZZJL-UHFFFAOYSA-N
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Elements H C S O