Formula |
C22H32N4O4++ |
IUPAC Name |
(1-methylpyridin-1-ium-3-yl) n-methyl-n-[6-[methyl-(1-methylpyridin-1-ium-3-yl)oxycarbonyl-amino]hexyl]carbamate |
Molecular Mass |
416.514 g·mol−1 |
Heat of Formation |
-515.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.50 ± 1.08 D |
Volume |
505.79 Å 3 |
Surface Area |
389.02 Å 2 |
HOMO Energy |
-7.14 ± 0.55 eV |
LUMO Energy |
3.51 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (1-methylpyridin-1-ium-3-yl) n-methyl-n-[6-[methyl-(1-methylpyridin-1-ium-3-yl)oxycarbonyl-amino]hexyl]carbamate
- (1-methylpyridin-1-ium-3-yl) n-methyl-n-[6-[methyl-(1-methylpyridin-1-ium-3-yl)oxycarbonylamino]hexyl]carbamate
- n-methyl-n-[6-[methyl-[(1-methyl-3-pyridin-1-iumyl)oxy-oxomethyl]amino]hexyl]carbamic acid (1-methyl-3-pyridin-1-iumyl) ester
|
InChIKey |
AHZBEVXBKNYXPU-UHFFFAOYSA-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
|
|
|