Geometry & MOs

Info

ID:	171041
PubChem CID:	75317189
Reduced:	ClSN2O6H23C24 (1)
Stoich.:	ABC2D6E23F24 (1)
Weight, g/mol:	536.80265
ΔH_f, kcal/mol:	-175.16
Dipole, Da:	2.35
IP(EA), eV:	-8.68(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[3,5-dibromo-4-[(2,4-dichlorophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCOCC3)OCC4=CC=C(C=C4)Cl

DOS

IR

Vibrations