Geometry & MOs

Info

ID:	159140
PubChem CID:	57260825
Reduced:	O2C7H12 (2)
Stoich.:	A2B7C12 (2)
Weight, g/mol:	636.458776
ΔH_f, kcal/mol:	-198.12
Dipole, Da:	3.0
IP(EA), eV:	-10.04(0.68)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-[2-[2-(heptadecylcarbamoyloxy)ethoxy]ethoxy]ethyl N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]carbamate

Drug info:

PubChemData

Smile

CCCCCCC=CC(CC(=O)OC)C(=O)OC

DOS

IR

Vibrations