Geometry & MOs

Info

ID:	87358
PubChem CID:	49894276
Reduced:	NSI2O3H19C25 (1)
Stoich.:	ABC2D3E19F25 (1)
Weight, g/mol:	538.01981
ΔH_f, kcal/mol:	-2.55
Dipole, Da:	3.87
IP(EA), eV:	-9.27(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[5-bromo-2-[(4-nitrophenyl)methoxy]phenyl]methylidene]-3-[(4-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=C(C(=CC(=C3)I)I)OCC4=CC=CC=C4)/SC2=O

DOS

IR

Vibrations