Geometry & MOs

Info

ID:	32667
PubChem CID:	7847059
Reduced:	ClNO3H20C21 (1)
Stoich.:	ABC3D20E21 (1)
Weight, g/mol:	365.162708
ΔH_f, kcal/mol:	-73.36
Dipole, Da:	3.03
IP(EA), eV:	-9.02(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenoxy)ethyl 2-ethyl-3-methylquinoline-4-carboxylate

Drug info:

PubChemData

Smile

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCCOC3=CC=CC=C3Cl

DOS

IR

Vibrations