(6R,12Ar)-2-Amino-6-(1,3-Benzodioxol-5-Yl)-2,3,6,7,12,12A-Hexahydropyrazino[1',2':1,6]Pyrido[3,4-B]Indole-1,4-Dione
Properties
Property | Value |
---|---|
Formula | C21H18N4O4 |
IUPAC Name | (6r,12ar)-2-amino-6-(1,3-benzodioxol-5-yl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione |
Molecular Mass | 390.392 g·mol−1 |
Heat of Formation | -174.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.41 ± 1.08 D |
Volume | 426.15 Å 3 |
Surface Area | 362.74 Å 2 |
HOMO Energy | -8.63 ± 0.55 eV |
LUMO Energy | -0.33 ± eV |
Point Group Symmetry | C1 |
InChIKey | VUKJGAVIWMPOOJ-FOIQADDNSA-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 |