Geometry & MOs

Info

ID:	285565
PubChem CID:	104113517
Reduced:	SN3O3C9H9 (1)
Stoich.:	AB3C3D9E9 (1)
Weight, g/mol:	253.052112
ΔH_f, kcal/mol:	-55.54
Dipole, Da:	7.85
IP(EA), eV:	-9.14(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-propan-2-yl-1,3-thiazol-2-yl)amino]-1,3-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)NC2=NC(=CO2)C(=O)O)C

DOS

IR

Vibrations