Geometry & MOs

Info

ID:	87789
PubChem CID:	49897362
Reduced:	SN2O6C24H26 (1)
Stoich.:	AB2C6D24E26 (1)
Weight, g/mol:	383.057592
ΔH_f, kcal/mol:	-197.5
Dipole, Da:	3.05
IP(EA), eV:	-8.88(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5Z)-5-[(2-nitrophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-phenylacetamide

Drug info:

PubChemData

Smile

CCOC1=CC2=C(C=C1)C=CC(=C2/C=C\3/C(=O)N(C(=O)S3)CC(=O)N4CCOCC4)OCC

DOS

IR

Vibrations