Geometry & MOs

Info

ID:	87388
PubChem CID:	49894446
Reduced:	NSCl2O5H21C27 (1)
Stoich.:	ABC2D5E21F27 (1)
Weight, g/mol:	443.01497
ΔH_f, kcal/mol:	-135.12
Dipole, Da:	5.51
IP(EA), eV:	-9.33(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC(=C3)C)Cl)OC(=O)C4=CC(=CC=C4)Cl

DOS

IR

Vibrations