Geometry & MOs

Info

ID:	254303
PubChem CID:	103124123
Reduced:	OSN2H12C17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	251.98983
ΔH_f, kcal/mol:	66.78
Dipole, Da:	2.45
IP(EA), eV:	-8.56(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromo-3-methylphenyl)-1H-imidazol-2-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CS2)CC(=O)C3=C4C=CC=CN4N=C3

DOS

IR

Vibrations