(1S,2S,3R,4R)-4-[(1E,3S)-3-Hydroxy-1-Buten-1-Yl]-3,5,5-Trimethyl-1,2,4-Cyclohexanetriol

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Formula C13H24O4
IUPAC Name (1s,2s,3r,4r)-4-[(e,3s)-3-hydroxybut-1-enyl]-3,5,5-trimethyl-cyclohexane-1,2,4-triol
Molecular Mass 244.327 g·mol−1
Heat of Formation -880.7 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 317.1 Å 3
Surface Area 263.65 Å 2
HOMO Energy -9.50 ± 0.55 eV
LUMO Energy 4.12 ± eV
Point Group Symmetry C1
InChIKey GOTQJVUEKCNRKB-MVIYIDSYSA-N
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Elements H C O