4-[4-(3-Buten-2-Yl)-2,6,7-Trioxabicyclo[2.2.2]Oct-1-Yl]Benzonitrile
Properties
| Property | Value |
|---|---|
| Formula | C16H17NO3 |
| IUPAC Name | 4-[4-[(1s)-1-methylallyl]-2,6,7-trioxabicyclo[2.2.2]octan-1-yl]benzonitrile |
| Molecular Mass | 271.311 g·mol−1 |
| Heat of Formation | -246.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.76 ± 1.08 D |
| Volume | 324.35 Å 3 |
| Surface Area | 289.9 Å 2 |
| HOMO Energy | -10.15 ± 0.55 eV |
| LUMO Energy | -0.81 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | JKNOWKAKZIKOMS-RCBQFDQVSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |