(1S,2R,3S,4R)-1-Acetoxy-5-Cyano-3,7-Dihydroxy-3-Methyl-6,11-Dioxo-2,3,4,5,6,11-Hexahydro-1H-Benzo[B]Carbazole-2,4-Diyl Bis(2-Methylpropanoate)
Properties
| Property | Value |
|---|---|
| Formula | C28H28N2O10 |
| IUPAC Name | [(1r,2r,3r,4s)-1-acetoxy-5-cyano-3,7-dihydroxy-3-methyl-2-(2-methylpropanoyloxy)-6,11-dioxo-2,4-dihydro-1h-benzo[h]carbazol-5-ium-4a-ylium-4-yl] 2-methylpropanoate |
| Molecular Mass | 552.529 g·mol−1 |
| Heat of Formation | -1512.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.77 ± 1.08 D |
| Volume | 623.09 Å 3 |
| Surface Area | 458.78 Å 2 |
| HOMO Energy | -9.69 ± 0.55 eV |
| LUMO Energy | 1.00 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UOYACWUCXHEGPZ-KALPRAJFSA-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 |