Geometry & MOs

Info

ID:	87771
PubChem CID:	49897174
Reduced:	BrSN3O6H22C24 (1)
Stoich.:	ABC3D6E22F24 (1)
Weight, g/mol:	518.00085
ΔH_f, kcal/mol:	-168.98
Dipole, Da:	2.3
IP(EA), eV:	-9.11(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(3-iodo-4,5-dimethoxyphenyl)methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

C1COCCN1C(=O)CN2C(=O)/C(=C/C3=CC(=C(C=C3)OCC(=O)NC4=CC=CC=C4)Br)/SC2=O

DOS

IR

Vibrations