Geometry & MOs

Info

ID:	254546
PubChem CID:	103126045
Reduced:	ON3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	181.030983
ΔH_f, kcal/mol:	44.04
Dipole, Da:	2.25
IP(EA), eV:	-8.57(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-thiazol-5-ylmethyl)-1H-imidazol-2-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)C(C3=CC(=CC=C3)OC)N

DOS

IR

Vibrations