Geometry & MOs

Info

ID:	121234
PubChem CID:	50759592
Reduced:	ClSO2N3H14C17 (1)
Stoich.:	ABC2D3E14F17 (1)
Weight, g/mol:	391.055754
ΔH_f, kcal/mol:	24.58
Dipole, Da:	1.12
IP(EA), eV:	-9.09(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-methylphenyl)-2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NOC(=N2)CSCC(=O)NC3=CC=CC=C3Cl

DOS

IR

Vibrations