Geometry & MOs

Info

ID:	87002
PubChem CID:	49890410
Reduced:	FNSO2H14C19 (1)
Stoich.:	ABCD2E14F19 (1)
Weight, g/mol:	454.136257
ΔH_f, kcal/mol:	-51.71
Dipole, Da:	4.58
IP(EA), eV:	-9.23(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(4-fluorophenyl)methyl]-5-[[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F

DOS

IR

Vibrations