Geometry & MOs

Info

ID:	194441
PubChem CID:	78537087
Reduced:	ClFN3O4H17C18 (1)
Stoich.:	ABC3D4E17F18 (1)
Weight, g/mol:	403.129884
ΔH_f, kcal/mol:	-185.95
Dipole, Da:	6.44
IP(EA), eV:	-8.97(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-ethylanilino)-2-oxoethyl] 3-(carbamoylamino)-3-(2-chlorophenyl)propanoate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(CC(=O)OCC(=O)NC2=CC=C(C=C2)F)NC(=O)N)Cl

DOS

IR

Vibrations