Geometry & MOs

Info

ID:	164702
PubChem CID:	74441382
Reduced:	NSO4C12H13 (1)
Stoich.:	ABC4D12E13 (1)
Weight, g/mol:	161.05105
ΔH_f, kcal/mol:	-147.75
Dipole, Da:	6.02
IP(EA), eV:	-9.19(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-1,3-thiazolidin-3-ium-4-carboxylate

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=C(C=C1)C2[NH2+]C(CS2)C(=O)[O-]

DOS

IR

Vibrations