Geometry & MOs

Info

ID:	88224
PubChem CID:	49902425
Reduced:	BrNSO6H22C23 (1)
Stoich.:	ABCD6E22F23 (1)
Weight, g/mol:	538.92246
ΔH_f, kcal/mol:	-183.27
Dipole, Da:	4.79
IP(EA), eV:	-8.86(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylidene]-3-[(4-bromophenyl)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=C(C=C3)Br)OCC(=O)OCC

DOS

IR

Vibrations