Geometry & MOs

Info

ID:	163006
PubChem CID:	57581343
Reduced:	O5C14H20 (1)
Stoich.:	A5B14C20 (1)
Weight, g/mol:	528.226037
ΔH_f, kcal/mol:	-206.95
Dipole, Da:	4.47
IP(EA), eV:	-9.04(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4-diethoxyphenyl)-N-[4-[4-(methoxymethoxy)phenyl]quinolin-2-yl]-4-oxobutanamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)C(CCC(=O)O)(OC)OC

DOS

IR

Vibrations