(1R,2S,3R,4S)-3-Acetoxy-11-Diazonio-2,4,10-Trihydroxy-2-Methyl-9-Oxo-1-(Propionyloxy)-2,3,4,9-Tetrahydro-1H-Benzo[B]Fluoren-5-Olate
Properties
| Property | Value |
|---|---|
| Formula | C23H20N2O9 |
| IUPAC Name | [(1r,2s,3r,4s)-3-acetoxy-2,4,9-trihydroxy-2-methyl-5,10-dioxo-1-propanoyloxy-3,4-dihydro-1h-benzo[b]fluoren-4b-id-11-yl]-λ1-azanyl-azanide |
| Molecular Mass | 468.413 g·mol−1 |
| Heat of Formation | -1190.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.77 ± 1.08 D |
| Volume | 507.37 Å 3 |
| Surface Area | 411.05 Å 2 |
| HOMO Energy | -9.49 ± 0.55 eV |
| LUMO Energy | -2.19 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YJMKDCSMTLNABN-AFXVXQJMSA-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 |