Geometry & MOs

Info

ID:	254521
PubChem CID:	103125859
Reduced:	N3C14H19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	205.048741
ΔH_f, kcal/mol:	41.84
Dipole, Da:	2.41
IP(EA), eV:	-8.51(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-nitrophenyl)-1H-imidazol-2-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)C(C3CCCC3)N

DOS

IR

Vibrations