(4S,4As,5As,6S,12Ar)-7-Chloro-4-(Dimethylamino)-1,6,10,11,12A-Pentahydroxy-N-(Hydroxymethyl)-6-Methyl-3,12-Dioxo-4,4A,5,5A-Tetrahydrotetracene-2-Carboxamide
Properties
Property | Value |
---|---|
Formula | C23H25ClN2O9 |
IUPAC Name | (4s,4as,5as,6s,12ar)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-n-(hydroxymethyl)-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide |
Molecular Mass | 508.906 g·mol−1 |
Heat of Formation | -1465.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.05 ± 1.08 D |
Volume | 543.33 Å 3 |
Surface Area | 388.2 Å 2 |
HOMO Energy | -9.00 ± 0.55 eV |
LUMO Energy | -1.27 ± eV |
Point Group Symmetry | C1 |
InChIKey | BXTHDFJCJQJHKD-KMVLDZISSA-N |
QR Code | Generate QR Code |
Links | PubChem |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |