Geometry & MOs

Info

ID:	227048
PubChem CID:	87559888
Reduced:	O4C11H20 (1)
Stoich.:	A4B11C20 (1)
Weight, g/mol:	632.500734
ΔH_f, kcal/mol:	-208.21
Dipole, Da:	3.92
IP(EA), eV:	-10.4(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-2-[3-(2-hydroxyethyl)-2-undecylimidazolidin-4-yl]acetic acid;2-(2-undecylimidazolidin-1-yl)ethanol

Drug info:

PubChemData

Smile

CC(CCCC(/C(=C(\C)/C(=O)O)/C)O)O

DOS

IR

Vibrations