Geometry & MOs

Info

ID:	86838
PubChem CID:	49889620
Reduced:	FNSI2O3H14C19 (1)
Stoich.:	ABCD2E3F14G19 (1)
Weight, g/mol:	622.98303
ΔH_f, kcal/mol:	-73.97
Dipole, Da:	4.66
IP(EA), eV:	-9.4(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1I)I)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F

DOS

IR

Vibrations