(5E)-7-{(1R,3R,5S)-2-[(1E)-4-(3-Chlorophenoxy)-3-Hydroxy-1-Buten-1-Yl]-3,5-Dihydroxycyclopentyl}-5-Heptenoic Acid

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Properties Simple | Detailed

Formula C22H29ClO6
IUPAC Name (z)-7-[(1r,2r,3s,5s)-2-[(e,3r)-4-(3-chlorophenoxy)-3-hydroxy-but-1-enyl]-3,5-dihydroxy-cyclopentyl]hept-5-enoic acid
Molecular Mass 424.915 g·mol−1
Heat of Formation -1112.0 ± 16.7 kJ·mol−1
Dipole Moment 1.84 ± 1.08 D
Volume 508.47 Å 3
Surface Area 378.65 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -0.31 ± eV
Point Group Symmetry C1
InChIKey VJGGHXVGBSZVMZ-GQAYNJGASA-N
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Elements H C O Cl