Geometry & MOs

Info

ID:	375784
PubChem CID:	134221774
Reduced:	SN2O3H16C17 (1)
Stoich.:	AB2C3D16E17 (1)
Weight, g/mol:	490.119858
ΔH_f, kcal/mol:	-75.49
Dipole, Da:	3.07
IP(EA), eV:	-8.84(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-(2,4-dioxo-1,3-thiazolidin-5-yl)-3-[4-(2-oxo-2-pyridin-2-ylethoxy)phenyl]propanoate

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)CCOC2=CC=C(C=C2)C[C@@H]3C(=O)NC(=O)S3

DOS

IR

Vibrations