4-(Dimethylamino)-3,10,12,12A-Tetrahydroxy-9-Nitro-1,11-Dioxo-1,4,4A,5,5A,6,11,12A-Octahydro-2-Tetracenecarboxamide
Properties
Property | Value |
---|---|
Formula | C21H21N3O9 |
IUPAC Name | (4s,4as,5ar,12as)-4-(dimethylamino)-3,10,12,12a-tetrahydroxy-9-nitro-1,11-dioxo-4a,5,5a,6-tetrahydro-4h-tetracene-2-carboxamide |
Molecular Mass | 459.406 g·mol−1 |
Heat of Formation | -1057.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.70 ± 1.08 D |
Volume | 488.53 Å 3 |
Surface Area | 396.27 Å 2 |
HOMO Energy | -9.37 ± 0.55 eV |
LUMO Energy | -1.60 ± eV |
Point Group Symmetry | C1 |
InChIKey | IEJWCNPEOOQYLP-CROFIWJMSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |