Geometry & MOs

Info

ID:	171248
PubChem CID:	75349370
Reduced:	ClNSO5H18C25 (1)
Stoich.:	ABCD5E18F25 (1)
Weight, g/mol:	515.095807
ΔH_f, kcal/mol:	-112.58
Dipole, Da:	7.44
IP(EA), eV:	-8.9(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-chlorophenoxy)ethyl]-5-[[4-(naphthalen-2-ylmethoxy)phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C3C(=O)N(C(=O)S3)CCOC4=CC=C(C=C4)Cl

DOS

IR

Vibrations