(5E)-7-(3,5-Dihydroxy-2-{(1E)-3-Hydroxy-4-[3-(Trifluoromethyl)Phenoxy]-1-Buten-1-Yl}Cyclopentyl)-5-Heptenoic Acid

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Properties Simple | Detailed

Formula C23H29F3O6
IUPAC Name (e)-7-[(1s,2s,3s,5r)-3,5-dihydroxy-2-[(e,3s)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoic acid
Molecular Mass 458.468 g·mol−1
Heat of Formation -1746.3 ± 16.7 kJ·mol−1
Dipole Moment 3.08 ± 1.08 D
Volume 544.71 Å 3
Surface Area 406.05 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
InChIKey WWSWYXNVCBLWNZ-PVHCAJHJSA-N
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Elements H C O F