(1R,6S)-1-[(2R,3S)-3-Heptyl-2-Oxiranyl]-2,4-Octadiyne-1,6-Diol

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Formula C17H26O3
IUPAC Name (1r,6s)-1-[(2r,3s)-3-heptyloxiran-2-yl]octa-2,4-diyne-1,6-diol
Molecular Mass 278.387 g·mol−1
Heat of Formation -180.3 ± 16.7 kJ·mol−1
Dipole Moment 1.17 ± 1.08 D
Volume 358.47 Å 3
Surface Area 329.57 Å 2
HOMO Energy -10.03 ± 0.55 eV
LUMO Energy -0.23 ± eV
Point Group Symmetry C1
InChIKey SNQQXKPWASLFFZ-VVLHAWIVSA-N
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Elements H C O