Geometry & MOs

Info

ID:	86929
PubChem CID:	49890027
Reduced:	FNSO4H28C29 (1)
Stoich.:	ABCD4E28F29 (1)
Weight, g/mol:	527.00635
ΔH_f, kcal/mol:	-85.35
Dipole, Da:	6.01
IP(EA), eV:	-8.74(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)OCCOC2=CC=CC=C2/C=C\3/C(=O)N(C(=O)S3)CC4=CC=C(C=C4)F

DOS

IR

Vibrations