Geometry & MOs

Info

ID:	86870
PubChem CID:	49889848
Reduced:	FNSO6H20C22 (1)
Stoich.:	ABCD6E20F22 (1)
Weight, g/mol:	501.036848
ΔH_f, kcal/mol:	-226.01
Dipole, Da:	3.29
IP(EA), eV:	-8.92(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F)OCC(=O)OC

DOS

IR

Vibrations