Geometry & MOs

Info

ID:	205984
PubChem CID:	80186343
Reduced:	FION2C12H14 (1)
Stoich.:	ABCD2E12F14 (1)
Weight, g/mol:	289.12782
ΔH_f, kcal/mol:	-38.83
Dipole, Da:	2.55
IP(EA), eV:	-8.96(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[1-(3-fluoro-4-methylphenyl)ethyl]-5-methylbenzamide

Drug info:

PubChemData

Smile

CN1C2COCC2CNC3=CC(=C(C=C31)F)I

DOS

IR

Vibrations