Geometry & MOs

Info

ID:	69460
PubChem CID:	47183088
Reduced:	INOH16C17 (1)
Stoich.:	ABCD16E17 (1)
Weight, g/mol:	402.96362
ΔH_f, kcal/mol:	16.93
Dipole, Da:	4.99
IP(EA), eV:	-8.54(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-4-iodophenyl)-3-(2-fluorophenyl)propanamide

Drug info:

PubChemData

Smile

CC1CCN(C2=CC=CC=C12)C(=O)C3=CC=CC=C3I

DOS

IR

Vibrations