Geometry & MOs

Info

ID:	61568
PubChem CID:	26710571
Reduced:	NOSC9H9 (2)
Stoich.:	ABCD9E9 (2)
Weight, g/mol:	316.122321
ΔH_f, kcal/mol:	-14.8
Dipole, Da:	3.3
IP(EA), eV:	-8.93(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-4-methoxybenzamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=CC=C(S2)CNC(=O)CC3=CC(=CC=C3)OC

DOS

IR

Vibrations