(19α,20α)-16-(Methoxycarbonyl)-19-Methyl-3,4,5,6,16,17-Hexadehydro-18-Oxayohimban-4-Ium-1-Ide
Properties
Property | Value |
---|---|
Formula | C21H20N2O3 |
IUPAC Name | (19alpha,20alpha)-16-(methoxycarbonyl)-19-methyl-3,4,5,6,16,17-hexadehydro-18-oxayohimban-4-ium-1-ide |
Molecular Mass | 348.395 g·mol−1 |
Heat of Formation | -155.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.38 ± 1.08 D |
Volume | 404.25 Å 3 |
Surface Area | 350.27 Å 2 |
HOMO Energy | -7.76 ± 0.55 eV |
LUMO Energy | -0.87 ± eV |
Point Group Symmetry | C1 |
CAS Number(s) |
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InChIKey | WYTGDNHDOZPMIW-RCBQFDQVSA-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 |