1-(4-Ethynylphenyl)-4-Propyl-2,6,7-Trioxabicyclo[2.2.2]Octane
Properties
Property | Value |
---|---|
Formula | C16H18O3 |
IUPAC Name | 1-(4-ethynylphenyl)-4-propyl-2,6,7-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 |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |