Geometry & MOs

Info

ID:	68085
PubChem CID:	46507730
Reduced:	SO2N5H29C30 (1)
Stoich.:	AB2C5D29E30 (1)
Weight, g/mol:	496.17467
ΔH_f, kcal/mol:	29.64
Dipole, Da:	5.21
IP(EA), eV:	-8.34(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-2-[4-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-oxoquinolin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C3=C(C(=NC=N3)N4CCC(CC4)C(=O)NCC5=CC=CC=C5OC)SC2=N1)C6=CC=CC=C6

DOS

IR

Vibrations