Geometry & MOs

Info

ID:	40361
PubChem CID:	8143992
Reduced:	ClO2N3H18C24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	347.061614
ΔH_f, kcal/mol:	50.79
Dipole, Da:	6.34
IP(EA), eV:	-8.85(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,5E)-2-[2-(furan-2-yl)-2-oxoethylidene]-5-(naphthalen-1-ylmethylidene)-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=CC3=C2N=C(C=C3)/C=N\NC(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations