Geometry & MOs

Info

ID:	195236
PubChem CID:	78662164
Reduced:	OSF3N6H13C16 (1)
Stoich.:	ABC3D6E13F16 (1)
Weight, g/mol:	347.163377
ΔH_f, kcal/mol:	-70.09
Dipole, Da:	2.36
IP(EA), eV:	-8.81(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3,4-dimethylphenyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]-2-methylpropanenitrile

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2NC1=C(C#N)C(=O)CSC3=NN=C(N3C)C(F)(F)F

DOS

IR

Vibrations