3,3'-{1,6-Hexanediylbis[(Methylcarbamoyl)Oxy]}Bis(1-Methylpyridinium)

Molecule SVG Image

Properties Simple | Detailed

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
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N