Geometry & MOs

Info

ID:	88217
PubChem CID:	49902334
Reduced:	NSBr2O4H21C26 (1)
Stoich.:	ABC2D4E21F26 (1)
Weight, g/mol:	392.94928
ΔH_f, kcal/mol:	-70.96
Dipole, Da:	3.22
IP(EA), eV:	-8.93(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(4-bromophenyl)methyl]-5-[(5-methylthiophen-2-yl)methylidene]-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)OCC4=CC=C(C=C4)Br

DOS

IR

Vibrations