Geometry & MOs

Info

ID:	86810
PubChem CID:	49889488
Reduced:	FNSO4H18C21 (1)
Stoich.:	ABCD4E18F21 (1)
Weight, g/mol:	508.110436
ΔH_f, kcal/mol:	-137.06
Dipole, Da:	3.23
IP(EA), eV:	-8.92(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1O)CC=C)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F

DOS

IR

Vibrations