Geometry & MOs

Info

ID:	61207
PubChem CID:	26707081
Reduced:	FSN3O5C23H28 (1)
Stoich.:	ABC3D5E23F28 (1)
Weight, g/mol:	426.170333
ΔH_f, kcal/mol:	-215.22
Dipole, Da:	4.1
IP(EA), eV:	-8.96(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-[2-(3-methoxyanilino)-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC1=CC(=CC=C1)OC)C(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations