Geometry & MOs

Info

ID:	171243
PubChem CID:	75348716
Reduced:	NSCl2O4H19C24 (1)
Stoich.:	ABC2D4E19F24 (1)
Weight, g/mol:	495.150429
ΔH_f, kcal/mol:	-98.77
Dipole, Da:	3.28
IP(EA), eV:	-8.57(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-[(2-methylphenyl)methoxy]phenyl]methylidene]-3-(2-naphthalen-1-yloxyethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)OCCN2C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)Cl)Cl)SC2=O

DOS

IR

Vibrations