Geometry & MOs

Info

ID:	171251
PubChem CID:	75349838
Reduced:	ClNSO7H24C27 (1)
Stoich.:	ABCD7E24F27 (1)
Weight, g/mol:	525.124609
ΔH_f, kcal/mol:	-209.25
Dipole, Da:	2.27
IP(EA), eV:	-8.64(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methoxy-4-[[3-(2-naphthalen-1-yloxyethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenyl] benzoate

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CCOC3=CC=CC4=CC=CC=C43)Cl)OCC(=O)OC

DOS

IR

Vibrations