Geometry & MOs

Info

ID:	65972
PubChem CID:	46484790
Reduced:	FN3O6C18H18 (1)
Stoich.:	AB3C6D18E18 (1)
Weight, g/mol:	419.145676
ΔH_f, kcal/mol:	-156.72
Dipole, Da:	3.51
IP(EA), eV:	-9.76(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethylphenyl)-2-[4-methyl-2,5-dioxo-4-[3-(trifluoromethyl)phenyl]imidazolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])F)C(=O)C3=CC=CO3

DOS

IR

Vibrations