Geometry & MOs

Info

ID:	9185
PubChem CID:	87053
Reduced:	NO6C26H53 (1)
Stoich.:	AB6C26D53 (1)
Weight, g/mol:	475.387288
ΔH_f, kcal/mol:	-361.03
Dipole, Da:	5.64
IP(EA), eV:	-8.95(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

acetic acid;2-[bis(2-hydroxyethyl)amino]ethyl octadecanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC(=O)OCCN(CCO)CCO.CC(=O)O

DOS

IR

Vibrations