3D,7D,11D-Phytanic Acid

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Formula C20H40O2
IUPAC Name (3s,7s,11r)-3,7,11,15-tetramethylhexadecanoic acid
Molecular Mass 312.530 g·mol−1
Heat of Formation -808.5 ± 16.7 kJ·mol−1
Dipole Moment 1.85 ± 1.08 D
Volume 466.29 Å 3
Surface Area 413.09 Å 2
HOMO Energy -10.47 ± 0.55 eV
LUMO Energy 0.97 ± eV
Point Group Symmetry C1
InChIKey RLCKHJSFHOZMDR-QYZOEREBSA-N
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Elements H C O