Geometry & MOs

Info

ID:	86930
PubChem CID:	49890030
Reduced:	FINSO4H19C21 (1)
Stoich.:	ABCDE4F19G21 (1)
Weight, g/mol:	387.094057
ΔH_f, kcal/mol:	-132.35
Dipole, Da:	4.31
IP(EA), eV:	-8.99(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1I)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F)OC

DOS

IR

Vibrations