Geometry & MOs

Info

ID:	195300
PubChem CID:	78670874
Reduced:	F2O2N3C21H25 (1)
Stoich.:	A2B2C3D21E25 (1)
Weight, g/mol:	357.157623
ΔH_f, kcal/mol:	-125.21
Dipole, Da:	1.68
IP(EA), eV:	-8.49(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-methoxy-5-methylanilino)-2-oxoethyl] 2-(3-methylphenoxy)propanoate

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)F)F)NCC(=O)N2CCN(CC2)C3=CC=CC=C3OC

DOS

IR

Vibrations