Geometry & MOs

Info

ID:	158142
PubChem CID:	56463051
Reduced:	SN4O5H16C20 (1)
Stoich.:	AB4C5D16E20 (1)
Weight, g/mol:	432.14337
ΔH_f, kcal/mol:	-42.95
Dipole, Da:	5.61
IP(EA), eV:	-9.09(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-N-[3-(5-oxo-2H-1,2,4-oxadiazol-3-yl)phenyl]-4-(pyridin-3-ylmethoxy)benzamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C(=O)NC2=CC=CC(=C2)C3=NC(=O)ON3)OCC4=CSC=N4

DOS

IR

Vibrations