Geometry & MOs

Info

ID:	87408
PubChem CID:	49894504
Reduced:	NSBr2O4H17C20 (1)
Stoich.:	ABC2D4E17F20 (1)
Weight, g/mol:	461.02964
ΔH_f, kcal/mol:	-102.34
Dipole, Da:	2.18
IP(EA), eV:	-9.04(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC(=C(C(=C1O)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)C)Br)Br

DOS

IR

Vibrations