Geometry & MOs

Info

ID:	68222
PubChem CID:	46507991
Reduced:	BrF3O3N4H14C20 (1)
Stoich.:	AB3C3D4E14F20 (1)
Weight, g/mol:	393.205242
ΔH_f, kcal/mol:	-160.93
Dipole, Da:	3.78
IP(EA), eV:	-9.93(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethylphenyl)-2-[4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC2=NC(=NO2)C3=CC(=CC=C3)C(F)(F)F)C4=CC(=CC=C4)Br

DOS

IR

Vibrations