12,13-Epoxytrichothec-9-Ene-4,7-Diol
Properties
| Property | Value |
|---|---|
| Formula | C15H22O4 |
| IUPAC Name | (1s,2s,3r,7r,9r,11r,12r)-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-3,11-diol |
| Molecular Mass | 266.333 g·mol−1 |
| Heat of Formation | -608.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.93 ± 1.08 D |
| Volume | 318.11 Å 3 |
| Surface Area | 259.55 Å 2 |
| HOMO Energy | -9.54 ± 0.55 eV |
| LUMO Energy | 0.91 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | HSKDIWXLQLBLPQ-KXPQCWJOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |