Geometry & MOs

Info

ID:	163036
PubChem CID:	57581441
Reduced:	SN2O3H22C26 (1)
Stoich.:	AB2C3D22E26 (1)
Weight, g/mol:	424.178693
ΔH_f, kcal/mol:	-23.72
Dipole, Da:	6.05
IP(EA), eV:	-8.7(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-ethoxyphenyl)-4-oxo-N-(4-phenylquinolin-2-yl)butanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=C(N=C(S2)NC(=O)CCC(=O)C3=CC=C(C=C3)O)C4=CC=CC=C4

DOS

IR

Vibrations