Geometry & MOs

Info

ID:	87592
PubChem CID:	49895668
Reduced:	ClN2S2O6H21C26 (1)
Stoich.:	AB2C2D6E21F26 (1)
Weight, g/mol:	449.085242
ΔH_f, kcal/mol:	-179.01
Dipole, Da:	10.33
IP(EA), eV:	-9.09(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[2-[(4-chlorophenyl)methoxy]phenyl]methylidene]-3-[(2-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2C(=O)/C(=C/C3=CC(=C(C=C3)OS(=O)(=O)C4=CC=C(C=C4)NC(=O)C)Cl)/SC2=O

DOS

IR

Vibrations