Geometry & MOs

Info

ID:	55621
PubChem CID:	17395685
Reduced:	ClOSN2H13C14 (1)
Stoich.:	ABCD2E13F14 (1)
Weight, g/mol:	497.198442
ΔH_f, kcal/mol:	7.2
Dipole, Da:	4.82
IP(EA), eV:	-9.1(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethylamino]-1-oxopropan-2-yl] 2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CC=N1)SC2=CC=C(C=C2)Cl

DOS

IR

Vibrations