7-[2-(2-Bromoethoxy)Phenyl]-2,3,9,10-Tetramethoxy-5,8,13,13A-Tetrahydro-6H-Isoquinolino[3,2-A]Isoquinolinium
Properties
Property | Value |
---|---|
Formula | C29H33BrNO5+ |
IUPAC Name | (7r,13as)-7-[2-(2-bromoethoxy)phenyl]-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5h-isoquinolino[2,1-b]isoquinolin-7-ium |
Molecular Mass | 555.480 g·mol−1 |
Heat of Formation | 3376.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.29 ± 1.08 D |
Volume | 539.23 Å 3 |
Surface Area | 441.11 Å 2 |
HOMO Energy | -9.13 ± 0.55 eV |
LUMO Energy | -2.73 ± eV |
Point Group Symmetry | C1 |
InChIKey | NPSIQLUTTDUDNB-DLLPINGYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O Br N |