Geometry & MOs

Info

ID:	86633
PubChem CID:	49887868
Reduced:	BrClNSO2H13C19 (1)
Stoich.:	ABCDE2F13G19 (1)
Weight, g/mol:	343.043378
ΔH_f, kcal/mol:	-10.33
Dipole, Da:	1.6
IP(EA), eV:	-9.33(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CN2C(=O)/C(=C/C=C/C3=CC=C(C=C3)Br)/SC2=O)Cl

DOS

IR

Vibrations