Geometry & MOs

Info

ID:	87156
PubChem CID:	49892733
Reduced:	NSCl2O4H27C29 (1)
Stoich.:	ABC2D4E27F29 (1)
Weight, g/mol:	423.009884
ΔH_f, kcal/mol:	-108.5
Dipole, Da:	2.98
IP(EA), eV:	-8.78(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(2,4-dichlorophenyl)methyl]-5-[(5-ethoxy-2-hydroxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)OCCOC2=CC=CC=C2/C=C\3/C(=O)N(C(=O)S3)CC4=C(C=C(C=C4)Cl)Cl

DOS

IR

Vibrations