Formula |
C21H26IN3O |
IUPAC Name |
(6ar,7r,9r)-n,n-diethyl-5-iodo-4,7-dimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-4-ium-9-carboxamide |
Molecular Mass |
463.355 g·mol−1 |
Heat of Formation |
83.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.80 ± 1.08 D |
Volume |
467.02 Å 3 |
Surface Area |
394.48 Å 2 |
HOMO Energy |
-8.21 ± 0.55 eV |
LUMO Energy |
2.63 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2-i-mil
- ergoline-8-carboxamide, 9,10-didehydro-n,n-diethyl-2-(iodo-125i)-1,6-dimethyl-, (8beta)-
- n(1)-methyl-2-iodo-lysergic acid diethylamide
- n-methyl-2-iodo-lsd
|
CAS Number(s) |
|
InChIKey |
TWQOQCUIXUGDKO-FZKQIMNGSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
I
H
C
O
N
|
|
|