Geometry & MOs

Info

ID:	87613
PubChem CID:	49895813
Reduced:	NSO6C23H23 (1)
Stoich.:	ABC6D23E23 (1)
Weight, g/mol:	524.172956
ΔH_f, kcal/mol:	-189.82
Dipole, Da:	4.35
IP(EA), eV:	-8.75(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-[(2,4-dimorpholin-4-yl-5-nitrophenyl)methylidene]-3-[(4-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC(=O)COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=CC(=C3)C)OC

DOS

IR

Vibrations