Geometry & MOs

Info

ID:	402840
PubChem CID:	135057462
Reduced:	N2O2C21H26 (1)
Stoich.:	A2B2C21D26 (1)
Weight, g/mol:	351.049411
ΔH_f, kcal/mol:	-46.65
Dipole, Da:	4.09
IP(EA), eV:	-8.66(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-2-(trifluoromethyl)-N-[4-(trifluoromethyl)phenyl]benzamide

Drug info:

PubChemData

Smile

CCCC1=C(C=CC(=C1)OCC=C(C)C)CNC(=O)C2=CC=CC=N2

DOS

IR

Vibrations