Geometry & MOs

Info

ID:	68902
PubChem CID:	46511460
Reduced:	FSN3O5C20H20 (1)
Stoich.:	ABC3D5E20F20 (1)
Weight, g/mol:	419.145676
ΔH_f, kcal/mol:	-143.8
Dipole, Da:	3.95
IP(EA), eV:	-9.64(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]-N-[2-(trifluoromethoxy)phenyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)NC(C)C)F

DOS

IR

Vibrations