Geometry & MOs

Info

ID:	178274
PubChem CID:	76307722
Reduced:	NSCl3O6H16C17 (1)
Stoich.:	ABC3D6E16F17 (1)
Weight, g/mol:	465.088223
ΔH_f, kcal/mol:	-238.58
Dipole, Da:	3.71
IP(EA), eV:	-9.2(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(2-methoxy-2-oxoethylidene)-4-oxo-1,3-thiazolidin-3-yl]propyl 9,10-dioxoanthracene-1-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C=C1N(C(=O)CS1)CCCOC(=O)COC2=CC(=C(C=C2Cl)Cl)Cl

DOS

IR

Vibrations