Geometry & MOs

Info

ID:	20111
PubChem CID:	579510
Reduced:	ON2F8H10C16 (1)
Stoich.:	AB2C8D10E16 (1)
Weight, g/mol:	398.066538
ΔH_f, kcal/mol:	-389.22
Dipole, Da:	3.97
IP(EA), eV:	-9.73(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[1,1,1,3,3,3-hexafluoro-2-(4-fluoroanilino)propan-2-yl]benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations