(5Z,11β)-9,15-Dioxo-11,16-Cycloprost-5-En-1-Oic Acid

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Properties Simple | Detailed

Formula C20H30O4
IUPAC Name (z)-7-[(1r,3as,4r,7as)-4-butyl-2,5-dioxo-3,3a,4,6,7,7a-hexahydro-1h-inden-1-yl]hept-5-enoic acid
Molecular Mass 334.450 g·mol−1
Heat of Formation -894.5 ± 16.7 kJ·mol−1
Dipole Moment 4.24 ± 1.08 D
Volume 440.61 Å 3
Surface Area 360.42 Å 2
HOMO Energy -9.95 ± 0.55 eV
LUMO Energy 3.59 ± eV
Point Group Symmetry C1
InChIKey CGCZPIJMGKLVTQ-VUVBZGNFSA-N
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