Geometry & MOs

Info

ID:	254488
PubChem CID:	103125624
Reduced:	OSN2H10C13 (1)
Stoich.:	ABC2D10E13 (1)
Weight, g/mol:	189.090212
ΔH_f, kcal/mol:	50.97
Dipole, Da:	2.08
IP(EA), eV:	-9.2(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(6-methylpyridin-3-yl)methyl]-1H-imidazol-2-one

Drug info:

PubChemData

Smile

CC1=C(C=CS1)C(=O)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations