Geometry & MOs

Info

ID:	226008
PubChem CID:	87246598
Reduced:	N3F6H17C19 (1)
Stoich.:	A3B6C17D19 (1)
Weight, g/mol:	399.117016
ΔH_f, kcal/mol:	-228.27
Dipole, Da:	5.56
IP(EA), eV:	-9.47(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyl-3-imidazolidin-1-yl-2,5-bis(trifluoromethyl)benzonitrile

Drug info:

PubChemData

Smile

C1CN(CN1)C2=CC=CC(C2(CC3=CC=CC=C3C(F)(F)F)C(F)(F)F)C#N

DOS

IR

Vibrations