1-(4-Ethynylphenyl)-4-Propyl-2,6,7-Trioxabicyclo[2.2.2]Octane

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Formula C16H18O3
IUPAC Name 4-(4-ethynylphenyl)-1-propyl-3,5,8-trioxabicyclo[2.2.2]octane
Molecular Mass 258.312 g·mol−1
Heat of Formation -233.5 ± 16.7 kJ·mol−1
Dipole Moment 3.91 ± 1.08 D
Volume 316.05 Å 3
Surface Area 289.86 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy -0.35 ± eV
Point Group Symmetry C1
InChIKey HFUCNMPQEAYQDJ-IYBDPMFKSA-N
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