Geometry & MOs

Info

ID:	371776
PubChem CID:	131271611
Reduced:	SN3O3C9H9 (1)
Stoich.:	AB3C3D9E9 (1)
Weight, g/mol:	239.036462
ΔH_f, kcal/mol:	-31.18
Dipole, Da:	3.6
IP(EA), eV:	-10.06(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-(4-methyl-1,3-thiazol-2-yl)-2-oxo-1H-imidazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CC2=NSC(=N2)C(=O)O

DOS

IR

Vibrations