Geometry & MOs

Info

ID:	230035
PubChem CID:	87569902
Reduced:	BCl2O3C7H15 (1)
Stoich.:	AB2C3D7E15 (1)
Weight, g/mol:	204.033054
ΔH_f, kcal/mol:	-250.48
Dipole, Da:	2.55
IP(EA), eV:	-10.29(0.27)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-ethyl-1,3-thiazolidin-3-ium-3,4-dicarboxylate

Drug info:

PubChemData

Smile

B(C(Cl)Cl)(O)OC(C)(C)C(C)(C)O

DOS

IR

Vibrations