8-Hydroxy-4-Methyl-11,16-Dioxo-14,21-Didehydrosenecionan-4-Ium-12-Yl Acetate
Properties
| Property | Value |
|---|---|
| Formula | C21H28NO7+ |
| IUPAC Name | 8-hydroxy-4-methyl-11,16-dioxo-14,21-didehydrosenecionan-4-ium-12-yl acetate |
| Molecular Mass | 406.450 g·mol−1 |
| Heat of Formation | 1444.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.94 ± 1.08 D |
| Volume | 434.56 Å 3 |
| Surface Area | 363.86 Å 2 |
| HOMO Energy | -8.78 ± 0.55 eV |
| LUMO Energy | -1.80 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NEHWGXHBNGZJNY-IYSGACFGSA-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 |