(5Z,9β,11Alpha,15S)-10,10-Difluoro-11,15-Dihydroxy-6,9-Epoxyprost-5-En-13-Yn-1-Oic Acid

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Properties Simple | Detailed

Formula C20H28F2O5
IUPAC Name (5z)-5-[(3ar,4s,5s,6ar)-6,6-difluoro-5-hydroxy-4-[(3s)-3-hydroxyoct-1-ynyl]-3a,4,5,6a-tetrahydro-3h-cyclopenta[b]furan-2-ylidene]pentanoic acid
Molecular Mass 386.430 g·mol−1
Heat of Formation -1263.1 ± 16.7 kJ·mol−1
Dipole Moment 7.57 ± 1.08 D
Volume 472.2 Å 3
Surface Area 422.92 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 3.63 ± eV
Point Group Symmetry C1
InChIKey CBLJBAMYHQOPFV-CGKYDKFLSA-N
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Elements H C O F