Geometry & MOs

Info

ID:	372463
PubChem CID:	131298043
Reduced:	SN2C11H12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	239.036462
ΔH_f, kcal/mol:	45.01
Dipole, Da:	3.11
IP(EA), eV:	-8.55(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-(2-methyl-1,3-thiazol-5-yl)-2-oxo-1H-imidazol-3-yl]acetic acid

Drug info:

PubChemData

Smile

C1CSC2=C1C=CC=C2C(CC#N)N

DOS

IR

Vibrations