Geometry & MOs

Info

ID:	271096
PubChem CID:	103643377
Reduced:	ClNOF2H8C13 (1)
Stoich.:	ABCD2E8F13 (1)
Weight, g/mol:	215.05132
ΔH_f, kcal/mol:	-92.54
Dipole, Da:	2.81
IP(EA), eV:	-9.37(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-5-fluorophenyl)butanamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)NC2=C(C=CC(=C2)F)Cl)F

DOS

IR

Vibrations