Geometry & MOs

Info

ID:	87023
PubChem CID:	49890700
Reduced:	SN3O3H19C22 (1)
Stoich.:	AB3C3D19E22 (1)
Weight, g/mol:	477.039749
ΔH_f, kcal/mol:	-50.74
Dipole, Da:	6.86
IP(EA), eV:	-8.81(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[[5-(2-chloro-4-nitrophenyl)furan-2-yl]methylidene]-3-(2-morpholin-4-yl-2-oxoethyl)-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)NC(=O)CN2C=C(C3=CC=CC=C32)/C=C\4/C(=O)NC(=O)S4

DOS

IR

Vibrations