Geometry & MOs

Info

ID:	86566
PubChem CID:	49887151
Reduced:	FNSO3H18C24 (1)
Stoich.:	ABCD3E18F24 (1)
Weight, g/mol:	465.080157
ΔH_f, kcal/mol:	-76.54
Dipole, Da:	4.43
IP(EA), eV:	-9.34(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-benzyl-5-[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C(=O)/C(=C/C3=CC=CC=C3OCC4=CC=C(C=C4)F)/SC2=O

DOS

IR

Vibrations