(5Z)-7-{(1R,2R,3R,5R)-5-Chloro-2-[(1E,3S)-3-Cyclohexyl-3-Hydroxy-1-Propen-1-Yl]-3-Hydroxycyclopentyl}-5-Heptenoic Acid

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Properties Simple | Detailed

Formula C21H33ClO4
IUPAC Name (e)-7-[(1r,2r,3r,5r)-5-chloro-2-[(e,3s)-3-cyclohexyl-3-hydroxy-prop-1-enyl]-3-hydroxy-cyclopentyl]hept-5-enoic acid
Molecular Mass 384.937 g·mol−1
Heat of Formation -965.5 ± 16.7 kJ·mol−1
Dipole Moment 0.88 ± 1.08 D
Volume 487.37 Å 3
Surface Area 367.69 Å 2
HOMO Energy -9.78 ± 0.55 eV
LUMO Energy 0.55 ± eV
Point Group Symmetry C1
InChIKey ZOQXTNLUBHPZOZ-OPWSBXINSA-N
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Elements H C O Cl