Geometry & MOs

Info

ID:	86602
PubChem CID:	49887544
Reduced:	ClNSO4H20C25 (1)
Stoich.:	ABCD4E20F25 (1)
Weight, g/mol:	499.041185
ΔH_f, kcal/mol:	-74.5
Dipole, Da:	3.57
IP(EA), eV:	-8.62(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC=C3Cl)OCC4=CC=CC=C4

DOS

IR

Vibrations