Geometry & MOs

Info

ID:	403249
PubChem CID:	135059377
Reduced:	NOC10H12 (2)
Stoich.:	ABC10D12 (2)
Weight, g/mol:	401.046217
ΔH_f, kcal/mol:	-34.27
Dipole, Da:	3.65
IP(EA), eV:	-8.87(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C/C=C/CCCC1=C(C=CC(=C1)OC)CNC(=O)C2=CC=CC=N2

DOS

IR

Vibrations