Geometry & MOs

Info

ID:	16846
PubChem CID:	477568
Reduced:	NSO4H11C12 (1)
Stoich.:	ABC4D11E12 (1)
Weight, g/mol:	265.040879
ΔH_f, kcal/mol:	-136.7
Dipole, Da:	7.25
IP(EA), eV:	-9.67(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-phenylacetyl) 2-oxo-1,3-thiazolidine-4-carboxylate

Drug info:

PubChemData

Smile

C1C(NC(=O)S1)C(=O)OC(=O)CC2=CC=CC=C2

DOS

IR

Vibrations