(9Ar)-3-Hexanoyl-9A-Methyl-6-[(E)-Prop-1-Enyl]-7,8-Dihydro-5H-Furo[3,2-G]Isoquinoline-5,6,8,8A-Tetraide-2,9-Dione
Properties
| Property | Value |
|---|---|
| Formula | C21H28NO4+ |
| IUPAC Name | (6r,8ar,9ar)-3-hexanoyl-9a-methyl-6-[(e)-prop-1-enyl]-6,7,8,8a-tetrahydro-5h-furo[3,2-g]isoquinolin-7-ium-2,9-dione |
| Molecular Mass | 358.451 g·mol−1 |
| Heat of Formation | -490.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 12.87 ± 1.08 D |
| Volume | 430.02 Å 3 |
| Surface Area | 384.05 Å 2 |
| HOMO Energy | -8.49 ± 0.55 eV |
| LUMO Energy | -1.41 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LBPWRWCAGFRUHW-OVIWPXTBSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |