Aspergilone A
Properties
Property | Value |
---|---|
Formula | C26H26O3 |
IUPAC Name | (3s,4r)-7,7-dibenzyl-3,4,5-trimethyl-3,4-dihydroisochromene-6,8-dione |
Molecular Mass | 386.483 g·mol−1 |
Heat of Formation | -338.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.76 ± 1.08 D |
Volume | 487.58 Å 3 |
Surface Area | 342.4 Å 2 |
HOMO Energy | -8.96 ± 0.55 eV |
LUMO Energy | -0.58 ± eV |
Point Group Symmetry | C1 |
InChIKey | SURSMSCPWPKKAE-HKUYNNGSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |