Geometry & MOs

Info

ID:	195324
PubChem CID:	78672381
Reduced:	FOS2N4C13H15 (1)
Stoich.:	ABC2D4E13F15 (1)
Weight, g/mol:	411.204573
ΔH_f, kcal/mol:	-23.32
Dipole, Da:	10.21
IP(EA), eV:	-8.65(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[1-[4-(2-methylpropyl)phenyl]ethylamino]-2-oxoethyl] 2-(4-acetylphenoxy)acetate

Drug info:

PubChemData

Smile

CCNC1=NN=C(S1)SC(C)C(=O)NC2=CC=C(C=C2)F

DOS

IR

Vibrations