Geometry & MOs

Info

ID:	374050
PubChem CID:	131323021
Reduced:	SN2O3C10H10 (1)
Stoich.:	AB2C3D10E10 (1)
Weight, g/mol:	238.041213
ΔH_f, kcal/mol:	-76.26
Dipole, Da:	6.56
IP(EA), eV:	-8.84(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,5-dimethyl-1,3-thiazol-4-yl)-2-methyl-1,3-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=C(C(=CN2C)O)C(=O)O

DOS

IR

Vibrations