Geometry & MOs

Info

ID:	276083
PubChem CID:	103820429
Reduced:	ClFION2H7C14 (1)
Stoich.:	ABCDE2F7G14 (1)
Weight, g/mol:	252.127406
ΔH_f, kcal/mol:	8.08
Dipole, Da:	4.6
IP(EA), eV:	-9.63(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N,2-dimethyl-N-[3-(methylamino)-3-oxopropyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C#N)F)NC(=O)C2=CC(=C(C=C2)I)Cl

DOS

IR

Vibrations