Geometry & MOs

Info

ID:	208714
PubChem CID:	80570814
Reduced:	SCl2N2O2H10C12 (1)
Stoich.:	AB2C2D2E10F12 (1)
Weight, g/mol:	221.025898
ΔH_f, kcal/mol:	-48.95
Dipole, Da:	8.71
IP(EA), eV:	-9.37(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(pyridin-3-ylamino)-1,3-thiazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)Cl)Cl)NC2=NC=C(S2)C(=O)O

DOS

IR

Vibrations