11-(1-Methyl-2-Pyrrolidinyl)-2-[(2-Methyl-2,3,4,9-Tetrahydro-1H-β-Carbolin-1-Yl)Methyl]-3-Vinyl-1,2,3,4,6,7,12,12B-Octahydroindolo[2,3-A]Quinolizin-10-Ol
Properties
| Property | Value |
|---|---|
| Formula | C35H43N5O |
| IUPAC Name | (2r,3r,5s,12br)-2-[[(1r,2r)-2-methyl-3,4-dihydro-1h-pyrido[3,4-b]indol-9-ium-9a-ylium-1-yl]methyl]-11-[(1r,2s)-1-methylpyrrolidin-2-yl]-3-vinyl-2,3,4,6,7,12b-hexahydro-1h-indolo[2,3-a]quinolizin-12-ium-12a-ylium-10-ol |
| Molecular Mass | 549.749 g·mol−1 |
| Heat of Formation | 214.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.25 ± 1.08 D |
| Volume | 685.04 Å 3 |
| Surface Area | 551.27 Å 2 |
| HOMO Energy | -7.87 ± 0.55 eV |
| LUMO Energy | 0.04 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PHLJPJICTIGOKC-FBJKZLERSA-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 |