Geometry & MOs

Info

ID:	87539
PubChem CID:	49895252
Reduced:	SN3O3H27C30 (1)
Stoich.:	AB3C3D27E30 (1)
Weight, g/mol:	526.99575
ΔH_f, kcal/mol:	-35.69
Dipole, Da:	1.08
IP(EA), eV:	-8.77(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[5-bromo-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=CN(C4=CC=CC=C43)CC(=O)NC(C)C5=CC=CC=C5)/SC2=O

DOS

IR

Vibrations