Geometry & MOs

Info

ID:	35977
PubChem CID:	7980590
Reduced:	NF3O3H18C22 (1)
Stoich.:	AB3C3D18E22 (1)
Weight, g/mol:	361.167794
ΔH_f, kcal/mol:	-204.94
Dipole, Da:	3.88
IP(EA), eV:	-8.58(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methylphenoxy)-N-[4-(4-methylphenoxy)phenyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)COC3=CC=CC(=C3)C(F)(F)F

DOS

IR

Vibrations