Geometry & MOs

Info

ID:	87082
PubChem CID:	49891709
Reduced:	FNSO5H18C25 (1)
Stoich.:	ABCD5E18F25 (1)
Weight, g/mol:	453.06017
ΔH_f, kcal/mol:	-145.43
Dipole, Da:	3.2
IP(EA), eV:	-8.86(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[4-[(4-chlorophenyl)methoxy]phenyl]methylidene]-3-[(2-fluorophenyl)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=C3F)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations