Geometry & MOs

Info

ID:	87069
PubChem CID:	49891511
Reduced:	FNSO3H20C28 (1)
Stoich.:	ABCD3E20F28 (1)
Weight, g/mol:	417.104622
ΔH_f, kcal/mol:	-59.94
Dipole, Da:	4.2
IP(EA), eV:	-9.03(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)COC3=CC=C(C=C3)/C=C\4/C(=O)N(C(=O)S4)CC5=CC=CC=C5F

DOS

IR

Vibrations