Geometry & MOs

Info

ID:	87944
PubChem CID:	49898868
Reduced:	ClFNSO3H15C25 (1)
Stoich.:	ABCDE3F15G25 (1)
Weight, g/mol:	550.081027
ΔH_f, kcal/mol:	-65.26
Dipole, Da:	2.61
IP(EA), eV:	-8.96(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-(naphthalen-2-ylmethyl)-5-[[2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)CN3C(=O)/C(=C/C4=CC=C(O4)C5=CC(=C(C=C5)F)Cl)/SC3=O

DOS

IR

Vibrations