Geometry & MOs

Info

ID:	88427
PubChem CID:	49903489
Reduced:	BrNSO5H22C27 (1)
Stoich.:	ABCD5E22F27 (1)
Weight, g/mol:	432.99834
ΔH_f, kcal/mol:	-121.16
Dipole, Da:	5.28
IP(EA), eV:	-8.82(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(2-bromophenyl)methyl]-5-[(3,5-dimethoxyphenyl)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=CC=C3Br)OC(=O)C4=CC=C(C=C4)C

DOS

IR

Vibrations