Geometry & MOs

Info

ID:	195124
PubChem CID:	78638682
Reduced:	NO2C10H10 (2)
Stoich.:	AB2C10D10 (2)
Weight, g/mol:	394.073177
ΔH_f, kcal/mol:	-90.62
Dipole, Da:	1.91
IP(EA), eV:	-8.62(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl] 2-(2-carbamoylphenoxy)acetate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)C(C)OC(=O)CC2=NOC3=CC=CC=C32

DOS

IR

Vibrations