Geometry & MOs

Info

ID:	87793
PubChem CID:	49897413
Reduced:	SN3O6H19C25 (1)
Stoich.:	AB3C6D19E25 (1)
Weight, g/mol:	388.109293
ΔH_f, kcal/mol:	-73.66
Dipole, Da:	7.52
IP(EA), eV:	-8.93(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC(=O)CN2C(=O)/C(=C/C3=CC=C(C=C3)OCC4=CC=C(C=C4)[N+](=O)[O-])/SC2=O

DOS

IR

Vibrations