Geometry & MOs

Info

ID:	69376
PubChem CID:	46530889
Reduced:	SN3O4C19H19 (1)
Stoich.:	AB3C4D19E19 (1)
Weight, g/mol:	383.130363
ΔH_f, kcal/mol:	-51.96
Dipole, Da:	2.07
IP(EA), eV:	-8.2(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methoxyphenyl)ethyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]benzamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CSC2=CC=CC=C2C(=O)NC3=C(C=C(C=C3)OC)OC

DOS

IR

Vibrations