Cicutoxin

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Properties Simple | Detailed

Formula C17H22O2
IUPAC Name (8e,10e,12e,14s)-heptadeca-8,10,12-trien-4,6-diyne-1,14-diol
Molecular Mass 258.355 g·mol−1
Heat of Formation 100.9 ± 16.7 kJ·mol−1
Dipole Moment 3.06 ± 1.08 D
Volume 348.42 Å 3
Surface Area 349.73 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy -0.92 ± eV
Point Group Symmetry C1
InChIKey FQVNSJQTSOVRKZ-ABNHZUPISA-N
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