Geometry & MOs

Info

ID:	87910
PubChem CID:	49898564
Reduced:	NSO3Cl4H11C21 (1)
Stoich.:	ABC3D4E11F21 (1)
Weight, g/mol:	533.002212
ΔH_f, kcal/mol:	-59.64
Dipole, Da:	4.7
IP(EA), eV:	-9.3(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[3-[(4-chlorophenyl)methoxy]-4-methoxyphenyl]methylidene]-3-[(2,6-dichlorophenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CN2C(=O)/C(=C/C3=CC=C(O3)C4=CC(=CC(=C4)Cl)Cl)/SC2=O)Cl)Cl

DOS

IR

Vibrations