3,7,8,10,12B-Pentahydroxy-9,12-Dimethoxy-3-(1-Methyl-2-Aziridinyl)-3,4,4A,12B-Tetrahydro-1,6(2H,5H)-Tetraphenedione
Properties
Property | Value |
---|---|
Formula | C23H25NO9 |
IUPAC Name | (3r,4as,12bs)-3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-3-[(2s)-1-methylaziridin-2-yl]-2,4,4a,5-tetrahydrobenzo[a]anthracene-1,6-dione |
Molecular Mass | 459.446 g·mol−1 |
Heat of Formation | -1292.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 10.05 ± 1.08 D |
Volume | 499.27 Å 3 |
Surface Area | 408.76 Å 2 |
HOMO Energy | -8.46 ± 0.55 eV |
LUMO Energy | 2.08 ± eV |
Point Group Symmetry | C1 |
InChIKey | FGEKNLXFZXJGOO-UEFMZXOESA-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 |