Geometry & MOs

Info

ID:	219380
PubChem CID:	85148339
Reduced:	NO2C32H47 (1)
Stoich.:	AB2C32D47 (1)
Weight, g/mol:	477.00343
ΔH_f, kcal/mol:	-90.68
Dipole, Da:	1.18
IP(EA), eV:	-9.29(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-bromophenyl)methylidene]-3-[2-oxo-2-(4-phenylphenyl)ethyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1C(N=C(O1)C2=CC=CC=C2)COCCCCCCCCCCCCCCCCC3=CC=CC=C3

DOS

IR

Vibrations