Geometry & MOs

Info

ID:	194583
PubChem CID:	78558722
Reduced:	FNCl3O3H11C16 (1)
Stoich.:	ABC3D3E11F16 (1)
Weight, g/mol:	413.058549
ΔH_f, kcal/mol:	-151.66
Dipole, Da:	2.75
IP(EA), eV:	-9.33(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-oxo-1-(2-phenylanilino)propan-2-yl] 3,4-dichlorobenzoate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=C(C=C(C=C1)F)Cl)OC(=O)C2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations